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C. Kiefer, S. Bestgen, M. T. Gamer, M. Kühn, S. Lebedkin, F. Weigend, M. M. Kappes, P. W. Roesky

Coinage Metal Complexes of Bis-Alkynyl-functionalized NHCs: Reactivity, Photophysical Properties and Quantum Chemical Investigations.

Chem. Eur. J. 2017, 23, 1591–1603.



C. Li, J. Liu, G. Lefkidis, W. Hübner

Reversible ultrafast spin switching on Ni@B80 endohedral fullerenes.

Phys. Chem. Chem. Phys. 2017, 673.



K. Krause, W. Klopper

Implementation of the Bethe2Salpeter Equation in the TURBOMOLE Program.

J. Comp. Chem. 2017, 38, 383–388.



N. Kazeminejad, D. Munzel, M. T. Gamer, P. W. Roesky

Bis(amidinate) ligands in early lanthanide chemistry – synthesis, structures, and hydroamination catalysis.

Chem. Commun. 2017, 53, 1060-1063.



J. Mohrbach, J. Lang, S. Dillinger, M. H. Prosenc, P. Braunstein, G. Niedner-Schatteburg

Vibrational fingerprints of a tetranuclear cobalt carbonyl cluster within an ion trap.

J. Mol. Spect. 2017, 332, 103-108.



F. Walz, E. Moos, D. Garnier, R. Köppe, C. E. Anson, F. Breher

A Redox-Switchable Germylene and its Ligating Properties in Selected Transition Metal Complexes.

Chem. Eur. J. 2017, 23, 1173 – 1186.



D. Imanbaew, J. Lang, M. F. Gelin, S. Kaufhold, M. G. Pfeffer, S. Rau, C. Riehn

Pump-probe fragmentation action spectroscopy: a powerful tool to unravel light-induced processes in molecular photocatalysts.

Angew. Chemie. 2017, Early View.



B. Schäfer, T. Bauer, I. Faus, J. A. Wolny, F. Dahms, O. Fuhr, S. Lebedkin, H.-C. Wille, K. Schlage,
K. Chevalier, F. Rupp, R. Diller, V. Schünemann, M. M. Kappes, M. Ruben

A luminescent Pt2Fe spin crossover complex.

Dalton Trans. 2017, 46, 2289-2302.


F. Rupp, K. Chevalier, M. Graf, M. Schmitz, H. Kelm, A. Grün, M. Zimmer, M. Gerhards, C. van Wüllen, H.-J Krüger, R. Diller

Spectroscopic, Structural and Kinetic Investigation of the Ultrafast Spin Crossover in an nusual Cobalt(II) Semiquinonate Radical Complex.

Chem. Eur. J. 2017, 2119-2132.



G. Lefkidis, S. Sold, W. Hübner

Relaxation of a coherent, magnetic s–p model system coupled to one and two thermal baths and a laser pulse.

J.  Magn. Magn. Mater. 2017, 432, 276–282.



W. Jin, D. Chaudhuri, C. Li, G. Lefkidis, W. Hübner

Laser-Induced Ultrafast Spin and Rotational Dynamics in Cobalt Trimer Cation.

J. Supercond. Nov. Magn. 2017, 30, 801–806.



A. Feyrer, M. K. Armbruster, K. Fink, F. Breher

Metal Complexes of a Redox-Active [1]Phosphaferrocenophane: Structures, Electrochemistry and Redox-Switchable Catalysis.

Chem. Eur. J. 2017, accepted.



A. Feyrer, F. Breher

Palladium Complexes of Ferrocene-Based Phosphine Ligands as Redox-Switchable Catalyst in Buchwald-Hartwig Cross-Coupling Reactions.

Inorg. Chem. Front., 2017, Advance Article.



Y. Peng, V. Mereacre, C. E. Anson, Y.-Q. Zhang, T. Bodenstein, K. Fink, A. K. Powell

Field-induced Co(II) SIMs with mer Directing Ligands but Ambiguous Coordination Geometry.

Inorg. Chem. 2017, accepted for publication.

DOI: 10.1021/acs.inorgchem.6b02743.


Y. Peng, V. Mereacre, C. E. Anson, A. K. Powell

The Role of Coordinated Solvent on Co(II) Ions in Tuning the Single Molecule Magnet Properties in a {CoII2DyIII2} System.

Dalton Trans. 2017, 46, 5337-5343.

DOI: 10.1039/c7dt00548b.



S. Chen, V. Mereacre, C. E. Anson, A. K. Powell

Systematic Studies of Hexanuclear {MIII4LnIII2} Complexes (M = Fe, Ga; Ln = Er, Ho): Structures, Magnetic Properties and SMM Behavior.

Inorg. Chem. Front. 2017, published online.

DOI: 10.1039/c7qi00091j.


S. F. M. Schmidt, C. Koo, V. Mereacre, J. Park, D. W. Heermann, V. Kataev, C. E. Anson, D. Prodius, G. Novitchi, R. Klingeler, A. K. Powell

A Three-Pronged Attack to Investigate the Electronic Structure of a Family of Ferromagnetic Fe4Ln2 Cyclic Coordination Clusters: A Combined Magnetic Susceptibility, HF-EPR and 57Fe Mössbauer Study.

Inorg. Chem. 2017, published online.

DOI: 10.1021/acs.inorgchem.6b02682


C. Kerner, J. P. Neu, M. Gaffga, J. Lang, B. Oelkers, Y. Sun, G. Niedner-Schatterburg and W. R. Thiel

Gas-phase reactivity of Cp* Group IX metal complexes bearing aromatic N,N’-chelating ligands.

New J. Chem. 2017, in print.

DOI: 10.1039/C7NJ01079F



T. O. Bauer, M. Schmitz, M. Graf, H. Kelm, H.- J. Krüger, V. Schünemann

Determination of Electronic Ground State Properties of a Dinuclear Iron(II) Spin Crossover Complex.

Hyperfine Interact. 2016, 237:78.



J. A. Wolny, Y. Garcia, I. Faus, S. Rackwitz, K. Schlage, H.-C. Wille, V. Schünemann

Nuclear Inelastic Scattering Study of a Dinuclear Iron(II) Complex Sbhowing a Direct Spin Transition.

Hyperfine Interact. 2016, 237:65.



S. V. Kruppa, Y. Nosenko, M.-O. Winghart, S. P. Walg, M. M. Kappes, C. Riehn

Fragmentation pathways of dianionic [Pt2(μ-P2O5H2)4 + X,Y]2- (X,Y = H, K, Ag) species in an ion trap induced by collisions and UV photoexcitation.

Int. J. Mass Spect. 2016, 395, 7–19.



L. Bergmann, G. Hedley, T. Baumann, S. Bräse, I. Samuel

Direct Observation of Intersystem Crossing in A Thermally Activated Delayed Fluorescence Copper Complex in the Solid State.

Science Adv. 2016, 2, e1500889.



M. Bazarnik, B. Bugenhagen, M. Elsebach, E. Sierda, A. Frank, M. H. Prosenc, R. Wiesendanger

Toward Tailored All-Spin Molecular Devices.

Nano Lett. 2016, 16, 577−582.



J. Lang, M. Cayir, S. P. Walg, P. Di Martino-Fumo, W. R. Thiel, G. Niedner-Schatteburg

Intermetallic Competition in the Fragmentation of Trimetallic Au–Zn–Alkali Complexes.


K. Krause, W. Klopper

Communication: A simplified coupled-cluster Lagrangian for polarizable embedding.

J. Chem. Phys. 2016, 144, 041101.



J.† Chmela, M. E. Harding, D. Matioszek, C. E. Anson, F. Breher, W. Klopper

Differential Many-Body Cooperativity in Electronic Spectra of Oligonuclear Transition-Metal Complexes.

ChemPhysChem 2016, 17, 37 – 45.



Weiquan Lin, T. Bodenstein, V. Mereacre, K. Fink, A. Eichhöfer

Field-Induced Slow Magnetic Relaxation in the Ni(I) Complexes [NiCl(PPh3)2]·C4H8O and [Ni(N(SiMe3)2)(PPh3)2].

Inorg. Chem. 2016, 55, 2091–2100.



T. Augenstein, F. Dorner, K. Reiter, H. E. Wagner, D. Garnier, W. Klopper, F. Breher

A Boron-fluorinated Tris(pyrazolyl)borate Ligand (FTp*) and ist Mono- and Dinuclear Copper Complexes [Cu(FTp*)2] and [Cu2(FTp*)2]: Synthesis, Structures and DFT Calculations.

Chem. Eur. J. 2016, 22, 7935-7943.


R. P. Kelly, P. W. Roesky

Catalytic Sigma-Bond Metathesis and the Polymerization of 1,3-Dienes by Rare-Earth Metal Complexes.

Structure and Bonding 2016, 85-117.



M. Yadav, A. Bhunia, S. K. Jana, P. W. Roesky

Manganese- and Lanthanide-Based 1D Chiral Coordination Polymers as an Enantioselective Catalyst for Sulfoxidation.

Inorg. Chem. 2016, 55, 2701–2708



V. Mereacre, M. Schlageter, A. Eichhöfer, T. Bauer, J. Wolny, V. Schünemann, A. K. Powell

Unusual metal-ligand charge transfer in ferrocene functionalized µ3-O iron carboxylates.

J. Magn. Magn. Mater. 2016, 407, 87-91.



S. Chen, V. Mereacre, C. E. Anson, A. K. Powell

A Single Molecule Magnet to Single Molecule Magnet Transformation via a Solvothermal Process: Fe4Dy2 → Fe6Dy3.

Dalton Trans. 2016, 45, 98-106. (Back cover).




F. S. Menges, S. M. Craig, N. Tötsch, A. Bloomfield, S. Ghosh, H.-J. Krüger, M. A. Johnson

Capture of CO2 by a Cationic Nickel(I) Complex in the Gas Phase and Characterization of the Bound, Activated CO2 Molecule by Cryogenic Ion Vibrational Predissociation Spectroscopy.

Angew. Chem. 2016, 128, 1304 –1307.



Y. Peng, V. Mereacre, C. E. Anson, A. K. Powell

Tuning of Hula-Hoop Coordination Geometry in Dy2 Dimers.

Inorganics 2016, 4, 2.



M.-O. Winghart, J.-P. Yang, M. Vonderach, A.-N. Unterreiner, D.-L. Huang, L.-S. Wang, S. Kruppa, C. Riehn, M. M. Kappes

Time-resolved photoelectron spectroscopy of a dinuclear Pt(II) complex: Tunneling autodetachment from both singlet and triplet excited states of a molecular dianion.

J. Chem. Phys. 2016, 144, 054305.



Y. Nosenko, C. Riehn, G. Niedner-Schatteburg

Self-pairing of 1-methylthymine mediated by two and three Ag(I) ions: a gas phase study using infrared dissociation spectroscopy and density functional theory.

Phys. Chem. Chem. Phys. 2016, 18, 8491-8501.



C. Braun, E. Spuling, N. Heine, M. Nieger, M. Cakici, S. Bräse

Efficient and Modular Synthesis of Isomeric Mono- and Bis-pyridylparacyclophanes by Cross-Coupling Reactions.

Adv. Synth. & Catal. 2016, 1664-1670.



B. E. C. Bugenhagen, M. H. Prosenc

Direct C-C coupling of two Ni-salophene complexes to yield Dinickel-Disalophene complexes with symmetric and non-symmetric substitution-patterns.

Dalton Trans. 2016, 45 , 7460 - 7468.



F. Völcker, P. W. Roesky

Bimetallic Rare-Earth/Platinum Complexes Ligated by Phosphinoamides.

Dalton Trans. 2016, 45, 9429-9435.



S. Bestgen, C. Schoo, C. Zovko, R. Kçppe, R. P. Kelly, S. Lebedkin, M. M. Kappes, P. W. Roesky

Early-Late Heterobi- and Trimetallic Complexes of Gold and Zirconium: Photoluminescence and Reactivity.

Chem. Eur. J. 2016, 22, 1–13.



T. R. Eger, I. Munstein, A. Steiner,Yu Sun, G. Niedner-Schatteburg, W. R. Thiel

New cationic organometallic phosphane ligands and their coordination to gold(I).

J. Organomet. Chem. 2016, 810, 51-56.



C. Schoo, S. V. Klementyeva, M. T. Gamer, S. N. Konchenko, P. W. Roesky

Samarocene oxide: from an undesired decomposition product to a new reagent.

Chem. Commun. 2016, 6654-6657.



B. K. T. Batagoda, P.I. Djurovich, S. Bräse, M.E. Thompson

Synthesis and characterization of phosphorescent cyclometalated Ir and Pt heteroleptic complexes using cyclophane-based chelates.

Polyhedron 2016, 116, 182–188.



L. Bergmann, D. M. Zink, S. Bräse, T. Baumann, D. Volz

Metal-organic and Organic TADF-Materials: Status, Challenges and Characterization.

Topics in Current Chemistry 2016, 373, 22.


D. Garnier, J.-R. Jimenez, Y. Li, J. von Bardeleben, Y. Journaux, T. Augenstein, E. Moos, M. T. Gamer, F. Breher, R. Lescouezec

The neutral complex K3{[FeII(Tp)(CN)3]4[CoIII(pzTp)]3[CoII(pzTp)]}: a soluble model of photomagnetic Prussian blue analogues.

Chem. Sci. 2016, 4825-4831.



D. Imanbaew, M. F. Gelin, C. Riehn

Rotational and vibrational dynamics in the excited electronic state of deprotonated and protonated fluorescein studied by time-resolved photofragmentation in an ion trap.

Struct. Dyn. 2016, 3, 043211.



Y. Nosenko, C. Riehn, W. Klopper

UV fragmentation and ultrafast dynamics of trinuclear silver/1-methylthymine and silver/1-ethyluracil metal-base pairs in an ion trap.

Chem. Phys. Lett. 2016, 659, 55–60.



B. Schäfer, J.-F. Greisch, I. Faus, T. Bodenstein, I. Salitros, O. Fuhr, K. Fink, V. Schünemann, M. M. Kappes, M. Ruben

Divergent Coordination Chemistry: Parallel Synthesis of [2 x 2] Iron(II) Grid-Complex Tauto-Conformers.

Angew. Chem. Int. Ed. 2016, 55, 10881–10885.



D. Loits, S. Bräse, A. J. North, J. M. White, P. S. Donnelly, M. A. Rizzacasa

Synthesis of Homochiral CoIII– and MnIV–[2.2]Paracyclophane Schiff Base Complexes with Predetermined Chirality at the Metal Centre.

Eur. J. Inorg. Chem. 2016, 3541-3544.



W. Yan, C. Rethore, S. Menning, G. Brenner-Weiß, T. Muller, P. Pierrat, S. Bräse

A Hexakis Terpyridine-Fullerene Ligand in Six-Fold Ruthenium, Iridium, and Iron Complexes: Synthesis and Electrochemical Properties.

Chem. Eur. J. 2016, 22, 3541–3544.



D. Volz, S. Bräse

Organische Leuchtdioden - Der Stand der Technik

GIT Laborjounal 2016, 10, 60-63. 


Y. Peng, V. Mereacre, C. E. Anson, A. K. Powell

Multiple superhyperfine fields in a {DyFe2Dy} coordination cluster revealed using bulk susceptibility and 57Fe Mössbauer studies.

Phys.Chem.Chem.Phys., 2016, 18, 21469-21480.



V. Mereacre,  M. Schlageter, A. Eichhofer, T. Bauer, J. A. Wolny, V. Schünemann, A. K.  Powell

Unusual metal-ligand charge transfer in ferrocene functionalized mu(3)-O iron carboxylates observed with Mossbauer spectroscopy.

J. Magn. Magn. Mater. 2016, 406, 87-91.


J. Kollamana, Z.  Wei, M.   Laux,  J.  Stockl, B. Stadtmuller, M.  Cinchetti, M.  Aeschlimann
Scanning Tunneling Microscopy Study of Ordered C-60 Submonolayer Films on Co/Au(111).

J. Phys. Chem. C 2016, 120,  7568-7574.



M. Gysler, F.  El Hallak, L. Ungur, R. Marx, M.  Hakl, P.  Neugebauer, Y. Rechkemmer, L. H. Lan, I. Sheikin,  M. Orlita, C. E. Anson, A. K.  Powell, R. Sessoli, L. F. Chibotaru, J. van Slageren

Multitechnique investigation of Dy3-implications for coupled lanthanide clusters.

Chem. Sci. 2016, 7, 4347-4354.



G. Lefkidis, S. A. Reyes

Quasianalytical treatment of the spin Seebeck effect on the Na2 molecule.

Phys. Rev. B  2016,  94, 144433.



C. Kiefer, S. Bestgen, M. T. Gamer, M. Kühn, S. Lebedkin, F. Weigend, M. M. Kappes, P. W. Roesky

Coinage Metal Complexes of Bis-Alkynyl-functionalized NHCs: Reactivity, Photophysical Properties and  Quantum Chemical Investigations.

Chem. Eur. J. 2016, in press.



P. Jäger, K. Brendle, U. Schwarz, M. Himmelsbach, M. K. Armbruster, K. Fink, P. Weis, M. M. Kappes

Q and Soret Band Photoexcitation of Isolated Palladium Porphyrin Tetraanions Leads to Delayed Emission of Nonthermal Electrons over Microsecond Time Scales.

J. Phys. Chem. Lett. 2016, 7, 1167−1172.



B. Helmich-Paris, C. Hättig, C. van Wüllen

Spin-Free CC2 Implementation of Induced Transitions between Singlet Ground and Triplet Excited States.

J. Chem. Theory Comput. 2016, 1892–1904.



L. Huang, A. Biafora, G. Zhang, V. Bragoni, L. J. Gooßen

Regioselective C-H Hydroarylation of Internal Alkynes with Arenecarboxylates: Carboxylates as Deciduous Directing Groups.

Angew. Chem. 2016, 128, 7047 –7051



T. Krause, S. Baader, B. Erb, L. J. Gooßen

Atom-economic catalytic amide synthesis from amines and carboxylic acids activated in situ with acetylenes.

Nature Commun. 2016, 7, 11732.



J. Tang, D. Hackenberger, L. J. Gooßen

Branched Arylalkenes from Cinnamates: Selectivity Inversion in Heck Reactions by Carboxylates as Deciduous Directing Groups.

Angew. Chem. Int. Ed. 2016, 55, 11296 –11299.



M. P. Drapeau, L. J. Gooßen

Carboxylic Acids as Directing Groups for C-H Bond Functionalization.

Chem. Eur. J. 2016, Early View.



A. Biafora, T. Krause, D. Hackenberger, F. Belitz, L. J. Gooßen

ortho-C-H Arylation of Benzoic Acids with Aryl Bromides and Chlorides Catalyzed by Ruthenium.

Angew. Chem. 2016, 128, 14972–14975.



Y. Peng, T. Bodenstein, K. Fink, V. Mereacre, C. E. Anson, A. K. Powell

Magnetic anisotropy of a CoII single ion magnet with distorted trigonal prismatic coordination: theory and experiment.

Phys. Chem. Chem. Phys. 2016, 18, 30135-30143.



N. Großmann, A. Magri, M. Laux, B. Stadtmüller, P. Thielen, B. Schäfer, O. Fuhr, M. Ruben, M. Cinchetti, M. Aeschlimann

Controlled manipulation of the Co–Alq 3interface by rational design of Alq3 derivatives.

Dalton Trans. 2016, 18365-18376.



K. Krause, M Bauer, W. Klopper

Approaching Phosphorescence Lifetimes in Solution: The Two-Component Polarizable-Embedding Approximate Coupled-Cluster Method.

J. Chem. Theor. Comp. 2016, 12, 2853-2860.



J.-F. Greisch, J. Chmela, M. E. Harding, W. Klopper, M. M. Kappes, D. Schooss

Gas-Phase Photoluminescence Characterization of Stoichiometrically Pure Nonanuclear Lanthanoid Hydroxo Complexes Comprising Europium or Gadolinium.

Inorg. Chem. 2016, 55, 3316–3323.



C. Kerner, J. Lang, M. Gaffga, Y. Sun, G. Niedner-Schatteburg, W. R. Thiel

Mech­anistic Studies on the Ruthenium(II) Catalyzed Base-free Transfer Hydrogenation Triggered by a Roll-over Cyclometallation.

Chempluschem 2016, accepted.



I. Mihalcea, M. Perfetti, F. Pineider, L. Tesi, V. Mereacre, F. Wilhelm, A. Rogalev, C. E. Anson, A. K. Powell, R. Sessoli,

Spin Helicity in Chiral Lanthanide Chains.

Inorg. Chem., 2016, 55, 10068-10074.



A. Wandler, S. Bräse

Expeditious Synthesis of Functionalized 1-Arylcyclooctadienes via Palladium-Catalyzed Lithium Cross-Coupling Reactions.

Adv. Syn. Catal. 2016, in press.


E. Deck, K. Reiter, W. Klopper, F. Breher

A Dinuclear Gold(I) Bis(Carbene) Complex Based on a Ditopic Cyclic (Aryl)(Amino)Carbene Framework.

Z. Anorg. Allg. Chem. 2016,1320-1328.



K. Brendle, U. Schwarz, P. Jäger, P. Weis, M. Kappes

Structures of Metalloporphyrin−Oligomer Multianions: Cofacial versus Coplanar Motifs as Resolved by Ion Mobility Spectrometry.

J. Phys. Chem. A 2016, 120, 8716−8724.



M. Wallesch, A. Verma, C. Fléchon, H. Flügge, D. M. Zink, S. Seifermann, J. M. M. Navarro, T. Vitova, J. Göttlicher, R. Steininger, L. Weinhardt, M. Zimmer, M. Gerhards, S. Bräse, T. Baumann, D. Volz

Towards Printed Organic Light-emitting Devices: A solution-stable, highly soluble Cu(I)-NHetPHOS-complex for inkjet processing.

Chem. Eur. J. 2016, 16400–16405.



A. Baniodeh, A. Mondal, R. Galeev, . Sukhanov, R. Eremina, V. Voronkova, C. E. Anson, A. K. Powell

How Far can the Anisotropy Deviate from Uniaxiality in a Dy-Based Single-Molecule Magnet? Dinuclear Dy(III) Complex Study.

Appl. Magn. Res., 2016, published online.



J. Lang, J. Mohrbach, S. Dillinger, J. M. Hewer, G.Niedner-Schatteburg

Vibrational Blue Shift of coordinated N2 in [Fe3O(OAc)6(N2)n]+: “Non Classical” Dinitrogen Complexes.

Chem. Commun., 2016, Accepted Manuscript.



C. Heitz, A. W. Jones, B. S. Oezkaya, C. L. Bub, M.-L. Louillat-Habermeyer, V. Wagner, F. W. Patureau

Ru-Catalyzed Dehydrogenative C−O Bond Formation with Anilines and Phenols.

Chem. Eur. J. 2016, 22, 17980–17982.



M. He, Z. Chen, E. M. Pineda, X. Liu, E. Bouwman, M. Ruben, P. W. Roesky

Homoleptic Chiral Benzamidinate Complexes of Rare-EarthElements: Synthesis, Structure, Luminescence, and Magnetism.

Eur. J. Inorg. Chem. 2016, 5512–5518







Λ-processes induced by chirped lasers

G. Lefkidis and W. Hübner

Springer Proc. Phys. 2015, 159, 128.


Ultrafast spin flip on homodinuclear clusters

W. Jin, C. Li, G. Lefkidis, W. Hübner

Springer Proc. Phys. 2015, 159, 134.


Effect of the variation of the bond length on laser-induced spin-flip scenarios at Ni2

D. Chaudhuri, G. Lefkidis, A. Kubas, K. Fink, W. Hübner

Springer Proc. Phys. 2015, 159, 159.


S. P. Walg, A. D. Schmidt, M. Schmitz, S. Farsadpour, J. Lang, M. Niebergall, Y. Sun, P. Roesky, G. Niedner-Schatteburg, W. R. Thiel

P,C-Bond Cleavage in the Ligand Sphere of a Nickel(II) Complex

Dalton Trans. 2015, 44, 1317-1322.



J. Goura, V. Mereacre, G. Novitchi, A. K. Powell, V. Chandrasekhar

Homometallic FeIII4 and Heterometallic {FeIII4Ln2} (Ln = Dy, Tb) Complexes – Syntheses, Structures, and Magnetic Properties.

Eur. J. Inorg. Chem. 2015, 156-165.



M. Yadav, V. Mereacre, S. Lebedkin, M. M. Kappes, A. K. Powell, P. W. Roesky

Mononuclear and Tetranuclear Compounds of Yttrium and Dysprosium Ligated by a Salicylic Schiff-Base Derivative: Synthesis, Photoluminescence, and Magnetism.

Inorg. Chem. 2015, 54, 773-781.



S. Bestgen, M. T. Gamer, S. Lebedkin, M. M. Kappes, P. W. Roesky

Di- and Trinuclear Gold Complexes of Diphenylphosphinoethyl-Functionalised Imidazolium Salts and their N-Heterocyclic Carbenes: Synthesis and Photophysical Properties.

Chem. Eur. J. 2015, 21, 601–614.



J. Meyer, S. Gonzalez-Gallardo, S. Hohnstein, D. Garnier, M. K. Armbruster, K. Fink, W. Klopper, F. Breher

Tris(3,5-dimethylpyrazolyl)methane-Based Heterobimetallic Complexes that Contain Zn- and Cd-Transition-Metal Bonds: Synthesis, Structures, and Quantum Chemical Calculations.

Chem. Eur. J. 2015, 20, 2905-2914.



V. Mereacre, M. Schlageter, A. K. Powell

A temperature induced ferrocene-ferrocenium interconversion in a ferrocene functionalized m 3-O chromium carboxylate

J. Magnet. Magn. Mat. 2015, 478-480.



A. W. Jones, M.-L. Louillat-Habermeyer, F. W. Patureau

Strained dehydrogenative ring closure of phenyl-carbazoles

Adv. Synth. Catal. 2015, 357, 945-949.



M.-L. Louillat-Habermeyer, R. Jin, F. W. Patureau

O2-mediated dehydrogenative amination of phenols

Angew. Chem. Int. Ed. 2015, 54, 4102-4104.



C. Li, J. Liu, S. Zhang, G. Lefkidis, W. Hübner

Strain modulation of ultrafast spin switching on Co_2@C_60 endohedral fullerenes.

Carbon 2015, 87, 153-162.



D. Volz, Y. Chen, M. Wallesch, R. Liu, C. Fléchon, D. M. Zink, J. Friedrichs, H. Flügge, R. Steininger, J. Göttlicher, C. Heske, L. Weinhardt, S. Bräse, F. So, T. Baumann

Bridging the efficiency gap: Fully Bridged Dinuclear Cu(I)-complexes for Singlet Harvesting in High-Efficiency OLEDs.

Adv. Mater. 2015, 27, 2538-2543.



M. Cakici, Z.-G. Gu, M. Nieger, J. Bürck, L. Heinke, S. Bräse

Planar-chiral building blocks for metal-organic frameworks.

Chem. Commun. 2015, 51, 4796-4798.



M. Enders, C. J. Friedmann, P. N. Plessow, A. Bihlmeier, M. Nieger, W. Klopper, S. Bräse

Unprecedented pseudo- ortho and ortho metallation of [2.2]paracyclophanes – a methyl group matters.

Chem. Commun. 2015, 51, 4793-4795.



L. Huang, M. Arndt, K. Gooßen, H. Heydt, L. J. Gooßen

Late Transition Metal-Catalyzed Hydroamination and Hydroamidation.

Chem. Rev. 2015, 115, 2596–2697.



A. Baniodeh, N. Magnani, S. Bräse, C. E. Anson, A. K. Powell

Ligand field variations: tuning the toroidal moment of Dy6 rings

Dalton Trans. 2015, 44, 6343-6347.



C. Sarcher, S. Bestgen, F. C. Falk, S. Lebedkin, J. Paradies, P. W. Roesky

Synthesis and photophysical properties of GemPhos noble metal complexes

J. Organomet. Chem. 2015, 795, 11-17.



S. V. Klementyeva, N. Arleth,K. Meyer, S. N. Konchenko, Peter W. Roesky

Dithionite and sulfinate complexes from the reaction of SO2 with decamethylsamarocene.

New J.Chem. 201539, 7589-7594.



M. Zimmer, F. Rupp, P. Singer, F. Walz, F. Breher, W. Klopper, R. Diller, M. Gerhards

Time-resolved IR spectroscopy of a trinuclear palladium complex in solution.

Phys.Chem.Chem.Phys. 2015, 17, 14138-14144.



S. Dillinger, J. Mohrbach, J. Hewer, M. Gaffga, G. Niedner-Schatteburg

Infrared spectroscopy of N2 adsorption on size selected cobalt cluster cations in isolation.

Phys.Chem.Chem.Phys. 2015, 17, 10358-10362.



F. Völcker, F. M. Mück, K. D. Vogiatzis, K. Fink, P. W. Roesky

Bi- and trimetallic rare-earth–palladium complexes ligated by phosphinoamides.

Chem. Commun. 2015, 51, 11761-11764.



D. Katayev, B. Exner, L. J. Gooßen

Synthesis of Biaryls by Decarboxylative Hiyama Coupling.

ChemCatChem 2015, 14, 2028–2032.



B. Maity, L. J. Gooßen, D. Koley

Computational study of the mechanism and selectivity of ruthenium-catalyzed hydroamidations of terminal alkynes.

Chem. Sci. 2015, 6, 2532-2552.



C. Kiefer, S. Bestgen, M. T. Gamer, S. Lebedkin, M. M. Kappes, P. W. Roesky

Alkynyl-functionalized gold NHC complexes and their coinage metal clusters.

Dalton Trans. 2015, 44, 13662-13670.



D. T. Thielemann, A. T. Wagner, Y. Lan, P. Oña-Burgos, I. Fernández, E. Rösch, D. K. Kölmel, A. K. Powell, S. Bräse, P. W. Roesky

Peptoid Ligated Pentadecanuclear Yttrium and Dysprosium Hydroxy Clusters

Chem. Eur. J. 2015, 2813-2820.



D. Volz, M. Wallesch, C. Fléchon, M. Danz, A. Verma, J. M. Navarro, S. Bräse, T. Baumann

From iridium and platinum to copper and carbon: new avenues for more sustainability in organic light-emitting diodes.

Green Chem. 2015, 1988 – 2011.



Metal-Catalyzed Cross-Coupling Reactions and More.

A. de Meijere, S. Bräse, M. Oestreich, Eds., Wiley-VCh, Weinheim, 2015. 978-3-527-33154-3


A. Mavrandonakis, K. D. Vogiatzis, A. D. Boese∥, K. Fink, T. Heine, W. Klopper

Ab Initio Study of the Adsorption of Small Molecules on Metal–Organic Frameworks with Oxo-centered Trimetallic Building Units: The Role of the Undercoordinated Metal Ion.

Inorg. Chem. 2015, 54, 8251–8263.



M. Galbiati, S. Tatay, S. Delprat, C. Barraud, V. Cros, E. Jacquet, F. Coloma, F.Choueikani, E. Otero, P. Ohresser, N. Haag, M. Cinchetti, M. Aeschlimann, P. Seneor, R. Mattana, F. Petroff

Influence of alkylphosphonic acid grafting on the electronic and magnetic properties of La2/3Sr1/3MnO3 surfaces.

Appl. Surf. Sci. 2015, 353, 24–28.



S. Jakobs, A. Narayan, B. Stadtmüller, A. Droghetti, I. Rungger, Y. S. Hor, S. Klyatskaya, D. Jungkenn, J. Stöckl, M. Laux, O. L. A. Monti, M. Aeschlimann, R. J. Cava, M. Ruben, S. Mathias, S. Sanvito, M. Cinchetti

Controlling the Spin Texture of Topological Insulators by Rational Design of Organic Molecules.

Nano Lett. 2015, 15, 6022–6029.



M. Yadav, A. Mondal, V. Mereacre, S. K. Jana, A. K. Powell, P. W. Roesky

Tetranuclear and Pentanuclear Compounds of the Rare-Earth Metals: Synthesis and Magnetism.

Inorg. Chem. 2015, 54, 7846–7856.



D. Imanbaew, Y. Nosenko, K. Chevalier, F. Rupp, C. Kerner, F. Breher, W. R. Thiel, R. Diller, C. Riehn, Excited-state dynamics of catalytically active transition metal complexes studied by transient photofragmentation in gas phase and transient absorption in solution.

Proc. XIXth Conf. Ultrafast Phenom. 2015, 162, 378-381.


A. D. Schmidt, Y. Sun, W. R. Thiel

Coordination of Nickel(II) by 3-(2-(Diphenyl-phosphino)phenyl)-1H-pyrazole.

Z. Anorg. Allg. Chem. 2015, 641, 2093–2101.



D. Hackenberger, B. Song, M. F. Grünberg, S. Farsadpour, F. Menges, H. Kelm, C. Groß, T. Wolff, G. Niedner-Schatteburg, W. R. Thiel, L. J. Gooßen

Bimetallic Cu/Pd Catalysts with Bridging Aminopyrimidinyl Phosphines for Decarboxylative Cross-Couplings at Moderate Temperatures.

ChemCatChem 2015, 21, 3579–3588.



J. Meyer, M. Tombers, C. van Wüllen, G. Niedner-Schatteburg, S. Peredkov, W. Eberhardt, M. Neeb, S. Palutke, M. Martins, W. Wurth

The spin and orbital contributions to the total magnetic moments of free Fe, Co and Ni clusters.

J. Chem. Phys. 2015, 143, 104302.



D. Dieleman, M. Tombers, L. Peters, J. Meyer, S. Peredkov, J. Jalink, M. Neeb, W. Eberhardt, T. Rasing, G. Niedner-Schatteburg, A. Kirilyuk

Orbit and spin resolved magnetic properties of size selected [ConRh]+ and [ConAu]+ nanoalloy clusters.

Phys. Chem. Chem. Phys. 201517, 28372-28378.



I. Faus, A. Reinhard, S. Rackwitz, J. A. Wolny, K. Schlage, H.-C. Wille, A. Chumakov, S. Krasutsky, P. Chaignon, C. D. Poulter, M.Seemann, V. Schünemann

Isoprenoid biosynthesis in pathogenic bacteria: Nuclear resonance vibrational spectroscopy provides more insight into the unusual [4Fe-4S] cluster of the LytB/IspHprotein.

Angew. Chem. Int. Ed. 2015, 127, 12771–12775.



Y. Lan, S. Klyatskaya, M. Ruben, O. Fuhr, W. Wernsdorfer, A. Candini, V. Corradini, A. Lodi Rizzini, U. del Pennino, F. Troiani, Loic Joly, D. Klar, H. Wende, M. Affronte

Magnetic interplay between two different lanthanides in a tris-phthalocyaninato complex: aviable synthetic route and detailed investigation in the bulk and on the surface.

J. Mater. Chem. C 2015, 3, 9794-9801.



K. Senthil Kumar, B. Schäfer, S. Lebedkin, L. Karmazin, M. M. Kappes, M. Ruben

Highly luminescent charge-neutral europium(III) and terbium(III) complexes with tridentate nitrogen ligands.

Dalton Trans. 2015, 44, 15611.




K. S. Kumar, I. Salitros, B. Heinrich, O. Fuhr, M. Ruben

A charge neutral iron(II) complex with an above room temperature spin crossover (SCO) and hysteresis loop.

J. Mater. Chem. C 2015, 3,11635-11644.



C. Li, J. Liu, S. Zhang, G. Lefkidis, W. Hübner

Strain Effect on the Ultrafast Spin Switching of Cobalt-Doped Carbon Fullerenes

IEEE Trans. Magn. 201551, 2900505.



D. Chaudhuri, W. Jin, G. Lefkidis, W. Hübner

Ab initio theory for femtosecond spin dynamics, angle-resolved fidelity analysis and the magneto-optical Kerr effect in Ni3(CH3OH) and Co3+(CH3OH) clusters.

J. Chem. Phys. 2015, 143, 174303.



M. Gaffga, I. Munstein, P. Müller, J. Lang, W. R. Thiel, G. Niedner-Schatteburg

Multi State Mediated Rearrangements and FeCl2 Elimination In Dinuclear FePd Complexes.

J. Phys. Chem. A 2015, 119, 12587–12598.



B.  Kern, J.-F.  Greisch, D.  Strelnikov, P.  Weis, A.  Böttcher, M. Ruben, B.  Schäfer, D.  Schooss, M.  Kappes

Photoluminescence Spectroscopy of Mass-Selected Electrosprayed Ions Embedded in Cryogenic Rare-Gas Matrixes.

Anal. Chem. 2015,  87, 11901–11906.



N. J. Rijs, T. Weiske, M. Schlangen, H. Schwarz

Effect of Adduct Formation with Molecular Nitrogen on the Measured Collisional Cross Sections of Transition Metal-1,10-Phenanthroline Complexes in Traveling Wave Ion-Mobility Spectrometry,: N2 is Not Always an "Inert" Buffer Gas.

Anal. Chem. 2015, 87, 9769-9776.



A. S. Kalyakina, V. V. Utochnikova, I. S. Bushmarinov, I. V. Ananyev, I. L. Eremenko, D. Volz, F. Rönicke, U. Schepers, R. Van Deun, A. L. Trigub, Y. V. Zubavichus, N. P. Kuzmina, S. Bräse

Highly Luminescent, Water-soluble Lanthanide Pentafluorobenzoates: Syntheses, Structures and Photophysics.

Chem. Eur. J. 2015, 21, 17921-17932.



I. Faus, S. Rackwitz, J. A. Wolny, A. Banerjee, H. Kelm, H.-J. Krüger, K. Schlage, H.-C. Wille, V. Schünemann

Site-selective detection of vibrational modes of an iron atom in a trinuclear complex.

Hyperfine Interact. 2015, accepted.


J.-Y. Chung, C. Schulz, H. Bauer, Yu Sun, H. Sitzmann, H. Auerbach, A. J. Pierik, V. Schünemann, A. Neuba, W. R. Thiel

Cyclopentadienide Ligand CpC– Possessing Intrinsic Helical Chirality and Its Ferrocene Analogues.

Organometallics, 2015, 34, 5374–5382




C. Sarchera, S. Lebedkin, M. M. Kappes, O. Fuhr, P. W. Roesky

Bi- and tetrametallic complexes of the noble metals with PNP-ligands.

J. Organomet. Chem. 2014, 751, 343–350.



Gold(I) complexes with heteroaryl phosphine ligands.

C. Sarcher, S. Farsadpour, L. Taghizadeh Ghoochany, Yu Sun, W. R. Thiel, P. W. Roesky

Dalton Trans., 2014, 2397-2405.



I. Trapp, S. González-Gallardo, S. Hohnstein, D. Garnier, P. Oña-Burgos, F. Breher

A metallacyclic alkyl-amido carbene complex (MCAAC).

Dalton Trans. 2014, 4313-4319.



S. González-Gallardo, I. Kuzu, P. Oña-Burgos, T. Wolfer, C. Wang, K. W. Klinkhammer, W. Klopper, S. Bräse, F. Breher

Coinage Metal Complexes of Tris(pyrazolyl)methanide-Based Redox-Active Metalloligands.

Organometallics 2014, 33, 941–951.



J.-F. Greisch, M. E. Harding, B. Schäfer, M. Rotter, M. Ruben, W. Klopper, M. M. Kappes, D. Schooss

Substitutional photoluminescence modulation in adducts of a europium chelate with a range of alkali metal cations: A gas-phase study.

J. Phys. Chem. A 2014, 118, 94-102.



W. Jin, C. Li, G. Lefkidis, W. Hübner

Laser control of ultrafast spin dynamics on homodinuclear iron- and nickel-oxide clusters.

Phys. Rev. B 89 2014, 024419.



M. Wallesch, D. Volz, D. M. Zink, U. Schepers, M. Nieger, T. Baumann, S. Bräse

Bright Coppertunities: Multinuclear Cu(I) Complexes with N-P-ligands and their Applications.

Chem. Eur. J. 2014, 22, 6578–6590.



Y. Schmitt, K. Chevalier, F. Rupp, M. Becherer, A. Grün, A. M. Rijs, F. Walz, F. Breher, R. Diller, M. Gerhards, W. Klopper

In-depth exploration of the photophysics of a trinuclear palladium complex.

Phys. Chem. Chem. Phys. 2014, 16, 8332-8338.



C. Sarcher, S. Farsadpour, L. Taghizadeh Ghoochany, Y. Sun, W. Thiel, P. W. Roesky

Mono- and Bimetallic Complexes of the Group 10 Metals with N-Heteroaryl Phosphine Ligands.

J. Organomet. Chem. 2014, 758, 29-35.



D. Imanbaew, Y. Nosenko, C. Kerner, K. Chevalier, F. Rupp, C. Riehn, W. R. Thiel, R. Diller

Excited state dynamics of a ruthenium(II)-catalyst studied by transient photofragmentation in the gas phase and transient absorption in solution.

Chem. Phys., 2014, 442, 53-61.



D. Volz, A. F. Hirschbiel, D. M. Zink, J. Friedrichs, M. Nieger, T. Baumann, S. Bräse, C. Barner-Kowollik

Highly Efficient Photoluminescent Cu(I)-PyrPHOS-Metallopolymers.

J. Mat. Chem. C 2014, 2, 1457-1462.



J. Kramer, C. Yildiz, M. Nieger, S. Bräse

Direct Access to 4,5-Disubstituted [2.2]Paracyclophanes by Selective ortho-Halogenation with Pd-Catalyzed C-H Activation.

Eur. J. Org. Chem. 2014, 1287–1295.



P. Weis, U. Schwarz, F. Hennrich, D. Wagner, S. Bräse, M. Kappes

Azaporphine guest-host complexes in solution and gas-phase: evidence for partially filled nanoprisms and exchange reactions.

Phys. Chem. Chem. Phys. 2014, 6225-6332.



W. Jin, M. Becherer, D. Bellaire, G. Lefkidis, M. Gerhards, W. Hübner

Infrared and electronic absorption spectra as well as ultrafast spin dynamics in isolated Co+3(EtOH) and Co+3(EtOH, H2O) clusters.

Phys. Rev. 2014, B 89, 144409.



C. Kaub, T. Augenstein, T. O. Bauer, E. Rothe, L. Esmezjan, V. Schünemann, P. W. Roesky

High-Coordinate Gold(I) Complexes with Dithiocarboxylate Ligands.

Inorg. Chem. 2014, 53, 4491–4499.



J.-F. Greisch, M. E. Harding, B. Schäfer, M. Ruben, W. Klopper, M. M. Kappes, D. Schooss

Characterization of nonanuclear europium and gadolinium complexes by gas-phase luminescence spectroscopy.

J. Phys. Chem. Lett. 2014, 5, 1727-1731.



J.-F. Greisch, M. E. Harding, W. Klopper, M. M. Kappes, D. Schooß

Effect of Proton Substitution by Alkali Ions on the Fluorescence Emission of Rhodamine B Cations in the Gas Phase.

J. Phys. Chem. A  2014, 118, 3787–3794.



C. Li, S. Zhang, W. Jin, G. Lefkidis, W. Hübner

Controllable spin-dynamics cycles and ERASE functionality on quasilinear molecular ions.

Phys. Rev. B 89 2014, 184404.



A. Hafner, N. Jung, S. Bräse

Silver-Mediated Perfluroalkylation Reactions.

Synthesis 2014, 46, 1440-1447.



Cu(II)- and Mn(III)-Porphyrin-Derived Oligomeric Multianions: Structures and Photoelectron Spectra

U. Schwarz, M. Vonderach, M. K. Armbruster, K. Fink, M. M. Kappes, P. Weis

J. Phys. Chem. A 2014, 118, 369–379.



M. Schmitz, M. Seibel, H. Kelm, S. Demeshko, F. Meyer, H.-J. Krüger

How Does a Coordinated Radical Ligand Affect the Spin Crossover Properties in an Octahedral Iron(II) Complex?

Angew. Chem. Int. Ed. Engl. 2014, 126, 6098–6102. (selected as Very Important Paper)



F. C. Falk, P. Oechsle, W. R. Thiel, C.-G. Daniliuc, J. Paradies

Unsymmetrical Bisphosphines for the Amidation of Aryl Chlorides: A Kinetic Study.

Eur. J. Org. Chem. 2014, 3637–3645.



A. Eichhöfer, V. Andrushko, T. Bodenstein, K. Fink

Trinuclear Early-Late Transition Metal Thiolate Complexes.

Eur. J. Inorg. Chem. 2014, 3510–3520.



D. Volz, M. Wallesch, S. Grage, J. Göttlicher, R. Steininger,D. Batchelor, A. Ulrich, C. Heske, L. Weinhardt, T. Baumann, S. Bräse

Labile or stable: Can homoleptic and heteroleptic PyrPHOS-copper complexes be processed from solution?

Inorg. Chem. 2014, 53, 7837–7847.



J. M. Serrano-Becerra, A. F. G. Maier, S. González-Gallardo, E. Moos, C. Kaub, M. Gaffga, G. Niedner-Schatteburg, P. W. Roesky, F. Breher, J. Paradies

Mono- versus Dinuclear Gold-Catalyzed Intermolecular Hydroamidation.

Eur. J. Org. Chem. 2014, 4515-4522.



M. Azimi, L. Chotorlishvili, S. K. Mishra, T. Vekua, W. Hübner, J. Berakdar

Quantum Otto heat engine based on a multiferroic chain working substance

New J. Phys. 2014, 16, 063018.



W. Hübner, G. Lefkidis, C.D. Dong, D. Chaudhuri, L. Chotorlishvili, J. Berakdar

Spin-dependent Otto quantum heat engine based on a molecular substance

Phys. Rev. B 2014, 90, 024401.



Daniel M Zink, Larissa Bergmann, David Ambrosek, Manuela Wallesch, Daniel Volz, Mathias Mydlak

Singlet harvesting copper-based emitters: a modular approach towards next-generation OLED technology

Translational Materials Research 2014, 015003.



J. Tang, L. J. Gooßen

Arylalkene Synthesis via Decarboxylative Cross-Coupling of Alkenyl Halides.

Org. Lett. 2014, 16, 2664-2667.



D. Katayev, K. F. Pfister, T. Wendling, L. J. Gooßen

Copper-Mediated ortho-Nitration of (Hetero)Arenecarboxylates.

Chem. Eur. J. 2014, 20, 9902-9905.



A. Fromm, C. van Wüllen, D. Hackenberger, L. J. Gooßen

Mechanism of Cu/Pd-Catalyzed Decarboxylative Cross-Couplings: A DFT Investigation.

J. Am. Chem. Soc. 2014, 136, 10007-10023.



S. Baader, P. E. Podsiadly, D. J. Cole-Hamilton, L. J. Gooßen

Synthesis of Tsetse Fly Attractants from a Cashew Nut Shell Extract by Isomerising Metathesis.

Green Chem. 2014, 16, 4885-4890.



S. V. Klementyeva, M. T. Gamer, A.-C. Schmidt, K. Meyer, S. N. Konchenko, P. W. Roesky

Activation of SO2 with [(η5-C5Me5)2Ln(THF)2] (Ln=Eu, Yb) Leading to Dithionite and Sulfinate Complexes

Chemistry - A Eur. J. 2014, 20, 13497-13500.



J. Lang, M. Gaffga, F. Menges, G. Niedner-Schatteburg

Two-color delay dependent IR probing of torsional isomerization in a [AgL1L2]+ complex.

Phys. Chem. Chem. Phys., 2014,16, 17417-17421.



C. Wilhelmi, M. Gaffga, Y. Sun, G. Niedner-Schatteburg, W. R. Thiel

A novel Bifunctional Ligand for the Synthesis of Polynuclear Alkynyl Complexes

Zeitschr. Naturforsch. B 2014, 69b, 1290-1298.



G. Peng, V. Mereacre, G. Kostakis, J. Wolny, V. Schünemann, A. K. Powell

Enhancement of Spin relaxation in FeDy2Fe Coordination Clusters by magnetic fields.

Chem. Eur. J. 2014, 20, 12381-12384



I. Mihalcea, N. Zill, V. Mereacre, C.E. Anson, A. K. Powell

Spontaneous Resolution in Homochiral Helical [Ln(nic)2(Hnic)(NO3)] Coordination Polymers Constructed from a Rigid Non-chiral Organic Ligand.

Cryst. Growth Des. 2014, 14, 4729–4734.



J.-L. Liu, J.-Y. Wu, Y.-C. Chen, V. Mereacre, A. K. Powell, L. Ungur, L. F. Chibotaru, X.-M. Chen, M.-L. Tong

A Heterometallic FeII–DyIII Single-Molecule Magnet with a Record Anisotropy Barrier.

Angew. Chem. Int. Ed. 2014, 53, 12966–12970.



A. Eichhöfer, Y. Lan, V. Mereacre, T. Bodenstein, F. Weigend

Slow Magnetic Relaxation in Trigonal-Planar Mononuclear Fe(II) and Co(II) Bis(trimethylsilyl)amido Complexes -A Comparative Study.

Inorg. Chem. 2014, 53, 1962−1974.



P. Bag, J. Goura, V. Mereacre, G. Novitch, A. K. Powell, V. Chandrasekhar

Synthesis, magnetism and Mössbauer studies of tetranuclear heterometallic {FeIII2Ln2}(Ln = Gd, Dy, Tb) complexes: evidence of slow relaxation of magnetization in the terbium analogue.

Dalton Trans., 2014, 43, 16366-16376.



D. Chaudhuri, H. P. Xiang, G. Lefkidis, W. Hübner

Laser-induced ultrafast spin dynamics in di-, tri- and tetranuclear nickel clusters, and the M process.

Phys. Rev. B 2014, 90, 245113.



C. Li, G. Lefkidis, W. Hübner

Electronic Theory of Ultrafast Spin Dynamics in NiO.

J. Nanomater. Mol. Nanotechnol. 2014, 3, 1000151.



J. Goura, P. Bag, V. Mereacre, A. K. Powell, V. Chandrasekhar

Molecular Iron(III) Phosphonates: Synthesis, Structure, Magnetism, and Mossbauer Studies.

Inorg. Chem 2014, 53, 8147-8154.

DOI: 10.1021/ic5012154


M. Cayir, L. Taghizadeh Goochany, A. Walli, M. Busch, Y. Sun, F. Meyer, S. Bräse, W. R. Thiel,

C-H Activation at a Bidentate Ligand coordinated to Palladium(II): an Electrophilic Attack Supported by an External Base.

Eur. J. Inorg. Chem. 2014, 2618-2624.


M. Enders, B. Görling, A. B. Braun, J. Seltenreich, L. Reichenbach, M. Nieger, K. Rissanen, B. Luy, U. Schepers, S. Bräse

Cytotoxicity and NMR Studies of Platinum Complexes with Cyclooctadiene Ligands.

Organometallics 2014, 33, 4027-4034.


S. Wolff, M. Crone, T. Muller, M. Enders, S. Bräse, M. Türk

Preparation of supported Pt nanoparticles by Supercritical Fluid Reactive Deposition: Influence of precursor, substrate and pressure on product properties.

J. Supercrit. Fluids 2014, 95, 588-596.


A. N. Kravtsova, K. A. Lomachenko, A. V. Soldatov, J. Meyer, G. Niedner-Schatteburg, S. Peredkov, W. Eberhardt, M. Neeb

Atomic and electronic structure of free niobium nanoclusters: Simulation of the M4,M5-XANES spectrum of Nb13+.

J. Electron Spectr. Related Phenomena 2014, 195, 189-194.



T. O. Bauer, M. Schmitz, M. Graf, H. Kelm, H.-J. Krüger, V. Schünemann

High-field Mössbauer spectroscopy on dinuclear iron(II) spin crossover complexes.

Hyperfine Interact. 2014, 226, 359–363.


I. Faus, S. Rackwitz, J. A. Wolny, M. Schmitz, H. Kelm, H.-J. Krüger, K. Schlage, H.-C. Wille, V. Schünemann

Nuclear inelastic scattering studies on a dinuclear iron(II) spin crossover complex.

Hyperfine Interact. 2014, 226, 211–216.



S. Rackwitz, I. Faus, M. Schmitz, H. Kelm, H.-J. Krüger, K. K. Andersson, H.-P. Hersleth, K. Achterhold, K. Schlage, H.-C. Wille, V. Schünemann, J. A.Wolny

A new sample environment for cryogenic nuclear resonance scattering experiments on single crystals and microsamples at P01, PETRA III.

Hyperfine Interact. 2014, 226, 673–678.




G. Lefkidis, W. Hübner

Analytical treatment of ultrafast laser-induced spin-flipping Λ processes on magnetic nanostructures.

Phys. Rev. B 2013, 87, 014404.



H. Braunschweig, F. Breher, S. Capper, K. Dück, M. Fuß, J. O. C. Jimenez-Halla, I. Krummenacher, T. Kupfer, D. Nied, K. Radacki

Heteroleptic [n]Chromoarenophanes: ansa Complexes Derived from [Cr(η5-C5H5)(η6-C6H6)].

Chem. Eur. J. 2013 , 19, 270-281. (selected as Very Important Paper).



M.-L. Louillat, F. W. Patureau

Toward Polynuclear Ru–Cu Catalytic Dehydrogenative C–N Bond Formation, on the Reactivity of Carbazoles.

Org. Lett., 2013, 15, 164–167.



J. J. P. Kramer, M. Nieger, S. Bräse

Synthesis of Novel Planar Chiral N-Heterocyclic Substituted Pyridinophanes.

Eur. J. Org. Chem. 2013, 541–549.



A. Bhunia, M. Yadav, Y. Lan, A. K. Powell, F. Menges, C. Riehn, G. Niedner-Schatteburg, P. P. Jana, R. Riedel, K. Harms, S. Dehnen, P. W. Roesky

Trinuclear nickel–lanthanide compounds

Dalton Trans. 2013, 42, 2445-2450.



A. Bhunia, M. A. Gotthardt, M. Yadav, M. T. Gamer, A. Eichhöfer, W. Kleist, P. W. Roesky

Salen-Based Coordination Polymers of Manganese and the Rare-Earth Elements: Synthesis and Catalytic Aerobic Epoxidation of Olefins.

Chem. Eur. J. 2013, 19, 1986 – 1995.



J. Meyer, I. Kuzu, S. González-Gallardo, F. Breher

Investigations on the Steric Accessibility of the Carbanionic Moiety in Zwitterionic Magnesium Tris(pyrazolyl)methanide Complexes. Synthesis and Characterisation of Bi- and Trimetallic Complexes.

Z. Anorg. Allg. Chem. 2013 , 639, 301–307.



M. Tombers, L. Barzen, G. Niedner-Schatteburg

Inverse H/D Isotope Effects in Benzene Activation by Cationic and Anionic Cobalt Clusters.

J. Phys. Chem. A, 2013, 117, 1197–1203.



G. Lefkidis, W. Hübner

First-principles dynamical calculation of a pump-probe scenario for the spin flip on NiO: Dynamical vs static calculation of the susceptibility tensor.

Phys. Rev. B. 2013, 87, 014432.



F. Rupp, K. Chevalier, M. M. N. Wolf, H.-J. Krüger, C. v. Wüllen, Y. Nosenko, G. Niedner-Schatteburg, C. Riehn and R. Diller

Photoinduced Processes in Cobalt-Complexes: Condensed Phase and Gas Phase.

Proc. Int. Conf. on Ultrafast Phenomena XVIII, 2013, 41, 05045.



M. Ganzhorn, S. Klyatskaya, M. Ruben, W. Wernsdorfer

Strong spin–phonon coupling between a single-molecule magnet and a carbon nanotube nanoelectromechanical system.

Nature Nanotechnology, 2013, 8,165-196.



D. Zink, M. Bächle, T. Baumann, M. Nieger, M. Kühn, C. Wang, W. Klopper, U. Monkowius, T. Hofbeck, H. Yersin, S. Bräse

Synthesis, structure, and characterization of dinuclear copper(I) halide complexes with N^P ligands featuring exciting photoluminescence properties.

Inorg. Chem. 2013, 52, 2292-2305.



B. Song, T. Knauber, L. J. Gooßen

Decarboxylative cross-coupling of mesylates catalyzed by copper/palladium with customized imidazolyl phosphine ligands.

Angew. Chem. 2013, 52, 2954–2951.



H. P. Xiang, G. Lefkidis and W. Hübner

First-principles study of the ultra-fast, laser-induced spin transferability in the multi-center magnetic cluster Ni3Na2.

J. Supercond. Nov. Magn. 2013, 26, 2001-2004.



C. D. Dong, G. Lefkidis and W. Hübner

Quantum isobaric process in Ni2.

J. Supercond. Nov. Magn. 2013, 26, 1589-1594.



S. Bhadra, W. Dzik, L. J. Gooßen

Synthesis of aryl ethers from benzoates via carboxylate-directed C-H activating alkoxylation with concomitant protodecarboxylation

Angew. Chem. 2013, 125, 3031-3035.



B. Murugesapandian, M. Kuzdrowska, M. T. Gamer, L. Hartenstein, P. W. Roesky

(Iminophosphoranyl)(thiophosphoranyl)methanide {CH(PPh2NSiMe3)(Ph2PS)}− as a Ligand in Rare-Earth-Element Chemistry.

Organometallics, 2013, 32, 1500-1506.



M.-O. Winghart, Ji-Ping Yang, M. Kühn, A.-N. Unterreiner, T. J. A. Wolf, P. D. Dau, H.-T. Liu, D.-L. Huang, W. Klopper, L.-S. Wang, M. M. Kappes

Electron tunneling from electronically excited states of isolated bisdisulizole-derived trianion chromophores following UV absorption.

Phys. Chem. Chem. Phys., 2013, 15, 6726-6736.



J.-F. Greisch, M. E. Harding, M. Kordel, W. Klopper, M. M. Kappes, D. Schooss

Intrinsic fluorescence properties of rhodamine cations in gas-phase: triplet lifetimes and dispersed fluorescence spectra.

Phys. Chem. Chem. Phys. 2013, 15, 8162-8170.



M. Kuzdrowska, L. Annunziata, S. Marks, M. Schmid, C. G. Jaffredo, P. W. Roesky, S. M. Guillaume, L. Maron

Organometallic calcium and strontium borohydrides as initiators for the polymerization of ε-caprolactone and L-lactide: combined experimental and computational investigations.

Dalton Trans., 2013, 42, 9352-9360.



U. Schwarz, M. Vonderach, M. Kappes, R. Kelting, K. Brendle, P. Weis

Structural characterization of metalloporphyrin-oligomer multianions by mass spectrometry and ion mobility spectrometry—Observation of metastable species.

Int. J. of Mass Spect. 2013, 339–340, 24– 33.



K. Muller, Y. Sun, A. Heimermann, F. Menges, G. Niedner-Schatteburg, C. van Wüllen, W. R. Thiel

Structure–Reactivity Relationships in the Hydrogenation of Carbon Dioxide with Ruthenium Complexes Bearing Pyridinylazolato Ligands.

Chem. Eur. J. 2013, 19, 7825 – 7834.



K. S. M. Salih, S. Bergner, H. Kelm, Y. Sun, A. Grün, Y. Schmitt, R. Schoch, M. Busch, N. Deibel, S. Bräse, B. Sarkar, M. Bauer, M. Gerhards, W R. Thiel

Trinuclear diamagnetic nickel(II) complexes bridged by 3-arylpyrazolato ligands.

Eur. J. Inorg. Chem. 2013, 6049-6059.



D. Volz, M. Nieger, J. Friedrichs, T. Baumann, S. Bräse

Small Change, Big Red Shift: Syntheses, Structure and Photoluminescence of Cu2Br2(Ph3P)2py2 (py = pyridine, 4-vinylpyridine).

Inorg. Chem. Comm. 2013, 37, 106–109.



K. Fink, V. Staemmler

A modified CAS-CI approach for an efficient calculation of magnetic exchange coupling constants.

Molecular Physics 2013, 16-17, 2594-2605.



F. Rajabi, J. Trampert, Y. Yu, M. Busch, S. Bräse, W. R. Thiel

Synthesis and Characterization of a 4-Nitrophenyl Functionalized NHC Ligand and its Palladium(II) Complex.

J. Organomet. Chem. 2013, 744, 101–107.



M. Busch, M. Cayir, M. Nieger, W. R. Thiel, S. Bräse

Roadmap towards novel N-heterocyclic [2.2]paracyclophanes

Eur. J. Org. Chem. 2013, 6108-6123.



S. Marks, P. W. Roesky

A Dinuclear Palladium(II) Complex of the {N(SPPh2)2} Ligand – Synthesis and Structure.

Z. Naturforsch. 2013, 68b, 557 – 560.



S. Styra, S. Gonzlez-Gallardo, F. Armbruster, P. Ona-Burgos, E. Moos, M. Vonderach, P. Weis, O. Hampe, A. Grün, Y. Schmitt, M. Gerhards, F. Menges, M. Gaffga, G. Niedner-Schatteburg, F. Breher

Heterobimetallic Cuprates Consisting of a Redox-Switchable, Silicon-Based Metallo-Ligand: Synthesis, Structures, and Electronic Properties

Chem. Eur. J. 2013, 19, 8436–8446.



Y. Nosenko, F. Menges, C. Riehn, G. Niedner-Schatteburg

Investigation by two-color IR dissociation spectroscopy of Hoogsteen-type binding in a metalated nucleobase pair mimic.

Phys.Chem.Chem.Phys. 2013,15, 8171-8178.



C. Li, S. Zhang, Wei Jin, G. Lefkidis, W. Hübner

Λ-Process-Based Spin Manipulation in Magnetic Endohedral Fullerenes.

IEEE Trans. on Magnetics 2013, 49, 3195-3198.



L. T. Ghoochany, C. Kerner, S. Farsadpour, F. Menges, Y. Sun, G. Niedner-Schatteburg, W. R. Thiel

C–H Activation at a Ruthenium(II) Complex – The Key Step for a Base-Free Catalytic Transfer Hydrogenation?

Eur. J. Inorg. Chem. 2013, 4305–4317.



H. Xiang, V. Mereacre, Y. Lan, T.-B. Lu, C. E. Anson, A. K. Powell

Direct observation of the role of lanthanides instabilizing a ferromagnetic spinorientation in a weak FeIII–FeIII antiferromagnet

Chem Commun., 2013, 49, 7385-7387.



T. Ehrenschwender, W. Schmucker, C. Wellner, T. Augenstein, P. Carl, J. Harmer, F. Breher, H.-A. Wagenknecht

Development of a Metal-Ion-Mediated Base Pair for Electron Transfer in DNA.

Chem. Eur. J. 2013, 19, 12547 – 12552.



D. Volz, D. M. Zink, T. Bocksrocker, J. Friedrichs, M. Nieger, T. Baumann, S. Bräse, U. Lemmer

A Molecular Construction Kit for Tuning Solubility, Stability and Luminescence Properties: Heteroleptic MePyrPHOS-Copperiodide-Complexes and their Application in Organic Light-Emitting Diodes.

Chem. Mater. 2013, 25, 3414–3426.



S. Wagner, F. Kisslinger, S. Ballmann, F. Schramm, R. Chandrasekar, T. Bodenstein, O. Fuhr, D. Secker, K. Fink, M. Ruben, H. B. Weber

Switching of a coupled spin pair in a single-molecule junction

Nature Nanotechnology 2013, 8, 575–579.



T. Karpuschkin, M. M. Kappes, O. Hampe

Binding of O2 and CO to Metal Porphyrin Anions in the Gas Phase

Angew.Chem.Int.Ed. 2013, 52, 10374–10377.



S. Rackwitz, W. Klopper, V. Schünemann, J. A. Wolny

Quantification of Intramolecular Cooperativity in Polynuclear Spin Crossover Fe(II) Complexes by Density Functional Theory Calculations.

Phys. Chem. Chem. Phys., 2013, 15, 15450-15458.



D. T. Thielemann, A. T. Wagner, Y. Lan, C. E. Anson, M. T. Gamer, A. K. Powell, P. W. Roesky

Slow magnetic relaxation in four square-based pyramidal dysprosium hydroxo clusters ligated by chiral amino acid anions – a comparative study.

Dalton Trans., 2013, 42, 14794-14800.



A. Baniodeh, V. Mereacre, N. Magnani, Y. Lan, J. A. Wolny, V. Schünemann, C.E. Anson, A. K. Powell

Para versus meta ligand substituents as a means of directing magnetic anisotropy in Fe2Dy2 coordination clusters.

Chem. Commun., 2013, 49, 9666-9668.



D. M. Zink, J. Friedrichs, T. Baumann, M. Nieger, S. Bräse

Copper(I) complexes based on five-membered P^N heterocycles: structural diversity linked to exciting luminescence properties.

Inorg. Chem. 2013, 52, 13509–13520.



D. M. Zink, D. Volz, T. Baumann, M. Mydlak, H. Flügge, J. Friedrichs, M. Nieger, S. Bräse

Heteroleptic, dinuclear copper(I) complexes for application in organic light-emitting diodes.

Chem. Mater. 2013, 25, 4471–4486.



S. Müller, S. Steil, A. Droghetti, N. Großmann, V. Meded, A. Magri, B. Schäfer, O. Fuhr, S. Sanvito, M. Ruben, M. Cinchetti, M. Aeschlimann

Spin-dependent electronic structure of the Co/Al(OP)3 interface

New J. Phys. 2013, 15, 113054.



N. Haag, S. Steil, N. Großmann, R. Fetzer, M. Cinchetti, M. Aeschlimann

Tailoring the energy level alignment at the Co/Alq3 interface by controlled cobalt oxidation

Appl. Phys. Lett. 2013, 103, 251603.



Felix Armbruster, Timo Augenstein, Pascual Ona-Burgos, and Frank Breher

Homoleptic Tetrakis-(silyl) Complexes of Pd0 and Pt0 Featuring Metal-Centred Heterocubane Structures: Evidence for the Existence of the Corresponding Mononuclear PdI and PtI Complexes.

Chem. Eur. J. 2013, 19, 17899 – 17906.



F. Völcker, Y. Lan, A. K. Powell, P. W. Roesky

Slow magnetic relaxation in tris(diphosphanylamido) and tetra(phosphanoamido) dysprosium complexes.

Dalton Trans., 2013, 42, 11471-11475.



C. D. Dong, G. Lefkidis and W. Hübner

Magnetic Quantum Diesel Engine in Ni2

Phys. Rev. B 2013, 88, 214421.




L. Bergmann, J. Friedrichs, M. Mydlak, T. Baumann, M. Nieger, S. Bräse

Outstanding luminescence from neutral copper(i) complexes with pyridyl-tetrazolate and phosphine ligands

Chem. Commun. 2013, 49, 6501-6503.



D. Volz, M. Nieger, J. Friedrichs, T. Baumann, S. Bräse

How the Quantum-efficiency of a Highly Emissive Binuclear Copper Complex is Enhanced by Changing the Processing Solvent

Langmuir 2013, 29, 3034-3044.



V. Mereacre, F. Klöwer, Y. Lan, R. Clérac, J. A. Wolny, V. Schünemann, C. E. Anson, A. K. Powell

Spin relaxation in Fe-Fe antiferromagnetic dimers slowed down by anisotropic DyIII ions.

Beilstein J. Nanotechnol. 2013, 4, 807–814.



I. Beljakov, V. Meded, F. Symalla, K. Fink, S. Shallcross, W. Wenzel

Magnetic anisotropy of graphene quantum dots decorated with a ruthenium adatom

Beilstein J. Nanotechnol. 2013, 4, 441–445.



S. Bhadra, W. Dzik, L. J. Gooßen

Synthesis of Aryl Ethers from Aromatic Carboxylic Acids.

Synthesis 2013, 45, 2387-2390.



S. Bhadra, C. Matheis, D. Katayev, L. J. Gooßen

Copper-Catalyzed Dehydrogenative Coupling of Arenes and Alcohols. 

Chem. Int. Ed.2013,52, 9279-9283.



S. Baader, D. Ohlmann, L. J. Gooßen

Isomerizing ethenolysis as an efficient strategy for styrene synthesis.

Chem. Eur. J. 2013, 19, 9807-9810.



K. S. M. Salih, P. Mamone, G. Dörr, T. O. Bauer, A. Brodyanski, C. Wagner, M. Kopnarski, R. N. Klupp Taylor, S. Demeshko, F. Mayer, V. Schünemann, S. Ernst, L. J. Gooßen, W. R. Thiel,

Facile Synthesis of Monodisperse Maghemite and Ferrite Nanocrystals from Metal Powder and Octanoic Acid.

Chem. Mater. 2013, 25, 1430-1435.



E. Kessler, S. Schmitt, C. van Wuellen

Broken symmetry approach to density functional calculation of zero field splittings including anisotropic exchange interactions .

J. Chem. Phys. 2013, 139, 184110.


A. Baniodeh, Y.  Lan, G. Novitchi, V. Mereacre, A. Sukhanov, M. Ferbinteanu, V. Voronkova, C. E. Anson, A. K. Powell

Magnetic anisotropy and exchange coupling in a family of isostructural Fe(2)(III)Ln(2)(III) complexes.

Dalton Trans. 2013, 42, 8926-8938.

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S. Farsadpour, L. T. Ghoochany, S. Shylesh, G. Dörr, A. Seifert, S. Ernst, W. R. Thiel

Covalently Supported Pyrimidinylphosphane Palladacycle as a Heterogenized Catalyst for the Suzuki–Miyaura Cross Coupling

ChemCatChem 2012, 4, 401-407.



M. Rudzki, A. Alcalde-Aragonés, W. I. Dzik, N. Rodríguez, L. J. Gooßen

Selective Copper- or Silver-Catalyzed Decarboxylative Deuteration of Aromatic Carboxylic Acids.

Synthesis 2012, 184-193.



S. H. Eitel, M. Bauer, D. Schweinfurth, N. Deibel, B. Sarkar, H. Kelm, H.-J. Krüger, W. Frey, R. Peters

Paramagnetic Palladacycles with PdIII Centers Are Highly Active Catalysts for Asymmetric Aza-Claisen Rearrangements

J. Am. Chem. Soc. 2012, 134, 4683–4693.



B. A. Khan, A. E. Buba, L. J. Gooßen

Oxidative Trifluoromethylation of Arylboronates with Shelf-Stable Potassium (Trifluoromethyl)trimethoxyborate.

Chem. Eur. J. 2012, 18, 1577-1581.



G. P. Zhang, G. Lefkidis, W. Hübner, Y. Bai

Manipulating femtosecond magnetization in ferromagnets and molecular magnets through laser chirp

J. Appl. Phys. 2012, 111, 07C508.



M. Hemgesberg, D. M. Ohlmann, Y. Schmitt, M. R. Wolfe, M. K. Müller, B. Erb, Y. Sun, L. J. Gooßen, M. Gerhards, W. R. Thiel

A Simple Access Sol-Gel Precursors Bearing Fluorescent Aromatic Core Units.

Eur. J. Org. Chem. 2012, 11, 2142–2151.



P. Benndorf, S. Schmitt, R. Kçppe, P.l Ona-Burgos, A. Scheurer, K. Meyer, P. W. Roesky

Catching Gaseous SO2 in Cone-Type Lanthanide Complexes: An Unexpected Coordination Mode for SO2 in f-Element Chemistry.

Angew. Chem. Int. Ed. 2012, 51, 5006-5010.



I. Šalitroš, O. Fuhr, A. Eichhöfer, R. Kruk, J. Pavlik, L. Dlháň, R. Boč, M. Ruben

The interplay of iron(II) spin transition and polymorphism.

Dalton Trans. 2012, 41, 5163–5171.



D. Jakubczyk, C. Barth, A. Kubas, F. Anastassacos, P. Koelsch, K. Fink, U. Schepers, G. Brenner-Weiß, S. Bräse

Deuterium-labelled N-acyl-L-homoserine lactones (AHLs)—inter-kingdom signalling molecules—synthesis, structural studies, and interactions with model lipid membranes.

Anal. Bioanal. Chem. 2012, 403, 473–482.



S. Rackwitz, J. A. Wolny, K. Muffler, H.-J. Krüger, S. Reh, H. Kelm, A. I. Chumakov, V. Schünemann

Installation of an IR microscope at the nuclear resonance beamline ID18 of ESRF.

Hyperfine Interactions 2012, 206(1-3), 63-66.



F. W. Patureau

Atom Tunneling in Organic Transformations

Angew. Chem. Int. Ed. 2012, 51, 4784–4786.



A. Bhunia, M. T. Gamer, L. Ungur, L. F. Chibotaru, A. K. Powell, Y. Lan, P. W. Roesky, F. Menges, C. Riehn, G. Niedner-Schatteburg

From a Dy(III) Single Molecule Magnet (SMM) to a Ferromagnetic [Mn(II)Dy(III)Mn(II)] Trinuclear Complex.

Inorg. Chem. 2012, 51, 9589–9597.



S. Dahmen, S. Bräse

Asymmetric catalytic dibutylzinc addition to imines using [2.2]paracyclophane based N,O-ligands as catalysts.

Isr. J. Chem. 2012, 52, 139–142.



J. A. Wolny, R. Diller, V. Schünemann

Vibrational Spectroscopy of Mono- and Polynuclear Spin-Crossover Systems.

Eur. J. Inorg. Chem. 2012, 2635–2648.



A. Kubas, S. Bräse, K. Fink

Theoretical Approach Towards the Understanding of Asymmetric Additions of Dialkylzinc to Enals and Iminals Catalysed by [2.2]Paracyclophane-Based N,O-Ligands.

Chem. Eur. J. 2012, 18, 8377–8385.



S. Bhadra, W. I. Dzik, L. J. Gooßen

Decarboxylative etherification of aromatic carboxylic acids.

J. Am. Chem. Soc. 2012, 134, 9938–9941.



P. Mamone, M.F. Grünberg, A.Fromm, B. A. Khan, L. J. Gooßen

[Pd(μ-Br)(PtBu3)]2 as a Highly Active Isomerization Catalyst: Synthesis of Enol Esters from Allylic Esters.

Org. Lett. 2012, 14, 3716-3719.



L. Greb, P. Oña-Burgos, A. Kubas, F. C. Falk , F. Breher, K. Fink, J. Paradies

[2.2]Paracyclophane derived bisphosphines for the activation of hydrogen by FLPs: application in domino hydrosilylation/hydrogenation of enones.

Dalton Trans. 2012, 41, 9056-9060.



W. I. Dzik, P. P. Lange, L. J. Gooßen

Carboxylates as Sources of Carbon Nucleophiles and Electrophiles: Comparison of Decarboxylative and Decarbonylative Pathways.

Chem. Sci. 2012, 2671-2678.



J. Schwöbel, Y. Fu, J. Brede, A. Dilullo, G. Hoffmann, S. Klyatskaya, M. Ruben, R. Wiesendanger

Real-space observation of spin-split molecular orbitals of adsorbed single-molecule magnets.

Nature Commun. 2012, 3, 953.



O. Hampe, S. Klyatskaya, T. Karpuschkina, M. Vonderach, P. Weis, M. Ruben, M. M. Kappes

Mass spectrometric characterization of a dinuclear terbium phthalocyaninato complex.

Int. J. Mass. Spectrom. 2012, 325–327, 183–188.



D. M. Ohlmann, N. Tschauder, J.-P. Stockis, K. Gooßen, M. Dierker, L. J. Gooßen

Isomerizing Olefin Metathesis as a Strategy to Access Defined Distributions of Unsaturated Compounds from Fatty Acids.

J. Am. Chem. Soc. 2012, 134, 13716–13729.



R. Vincent, S. Klyatskaya, M. Ruben, W. Wernsdorfer, F. Balestro

Electronic read-out of a single nuclear spin using a molecular spin transistor.

Nature 2012, 488, 357-360.



D. Volz. M. Nieger, S. Bräse

Di--iodido-bis{[(R)-(+)-2,2'-bis(diphenylphosphanyl)-1,1'-binaphthyl-2P,P']copper(I)} 0.67-hydrate.

Acta Cryst. E 2012, E68, m466-m467.



C. Li, F. Yang, W. Jin, H.P. Xiang, G. Lefkidis, W. Hübner

Coherent ultrafast spin-switching Lambda processes in chainlike nanostructures with two identical magnetic centers.

J. Magn. Magn. Mat. 2012 324, 4024-4029.



F. Manjolinho, M. Arndt, K. Gooßen, L. J. Gooßen

Catalytic C−H carboxylation of terminal alkynes with carbon dioxide.

ACS Catal. 2012, 2, 2014−2021.



D. Volz, T. Baumann, H. Flügge, M. Mydlak, T. Grab, M. Bächle, C. Barner-Kowollik, S. Bräse

Auto-catalysed crosslinking for next-generation OLED design.

J. Mater. Chem. 2012, 20786-20790.



V. Mereacre

Differentiation of Highly Anisotropic TbIII and DyIII with 57Fe Mössbauer Spectroscopy.

Angew. Chem. Int. Ed. 2012, 51, 9922–9925.



Y. Pavlyukh, J. Berakdar, W. Hübner

Semi-classical approximation for second-harmonic generation in nanoparticles.

New J. Phys. 2012,14, 093044.



H. Xiang, G. Lefkidis, W. Hübner

Unified theory of ultrafast femtosecond and conventional picosecond magnetic dynamics in the distorted three-center magnetic cluster Ni3Na2

Phys. Rev. B 201286, 134402.



S. Rackwitz, J.A. Wolny, K. Muffler, K. Achterhold, R. Rüffer, Y. Garcia, R. Diller, V. Schünemann

Vibrational properties of the polymeric spin crossover (SCO) Fe(II) complexes [{Fe(4-amino-1,2,4-triazole)3 }2 ]n : A nuclear inelastic scattering (NIS), Raman and DFT study.

Phys. Chem. Chem. Phys. 2012, 14, 14650-14660.



C. Sarcher, A. Lühl, F. C. Falk, S. Lebedkin, M. Kühn, C. Wang, J. Paradies, M. M. Kappes, W. Klopper, P. W. Roesky

[2.2]Paracyclophanediyldiphosphane Complexes of Gold.

Eur. J. Inorg. Chem. 2012, 5033–5042.



K. Ch. Mondal, A. Sundt, Y. Lan, G. E. Kostakis, O. Waldmann, L. Ungur, L. F. Chibotaru, C. E. Anson, A. K. Powell

Coexistence of Distinct Single-Ion and Exchange-Based Mechanisms for Blocking of Magnetization in a CoII2DyIII2 Single-Molecule Magnet.

Angew. Chem. Int. Ed. 2012, 51, 7550 –7554.



G. E. Kostakis, S. P. Perlepes, V. A. Blatov, D. M. Proserpio, A. K. Powell

High-nuclearity cobalt coordination clusters: Synthetic, topological and magnetic aspects.

Coord. Chem. Rev. 2012, 256, 1246–1278.



L. Barzen, M. Tombers, C. Merkert, J. Hewer, G. Niedner-Schatteburg

Benzene activation and H/D isotope effects in reactions of mixed cobalt
platinum clusters: The influence of charge and of composition.

Int. J. Mass Spect. 2012, 330–332, 271–276.



W. Jin, F. Rupp, K. Chevalier, M.M.N. Wolf, M. Colindres Rojas, G. Lefkidis, H.-J. Krüger, R. Diller, W. Hübner

Combined theoretical and experimental study of spin and charge dynamics on the homodinuclear complex  [Ni2II(L-N4Me2)(emb)].

Phys. Rev. Lett. 2012, 109, 267209.



Yi-Qi Zhang, N. Kepcija, M. Kleinschrodt, K. Diller, S. Fischer, A C. Papageorgiou, F. Allegretti, J. Björk, S. Klyatskaya, F. Klappenberger, M. Ruben, J. V. Barth

Homo-coupling of terminal alkynes on a noble metal surface.

Nature Commun. 2012, 3:1286, 1-8.



S. Kisslinger, H. Kelm, S. Zheng, A. Beitat, C. Würtele, R. Wortmann, S. Bonnet, S. Herres-Pawlis, H.-J. Krüger, S. Schindler

Synthesis and Characterization of Iron(II) Thiocyanate Complexes with

Derivatives of the Tris(pyridine-2-ylmethyl)amine (tmpa) Ligand.

Z. Anorg. Allg. Chem. 2012, 638, 2069–2077.



T. Brietzke, W. Mickler, A. Kelling, U. Schilde, H.-J. Krüger, H.-J. Holdt

Mono- and Dinuclear Ruthenium(II)–1,6,7,12-Tetraazaperylene Complexes of N,N-Dimethyl-2,11-diaza[3.3](2,6)-pyridinophane.

Eur. J. Inorg. Chem. 2012, 4632–4643.



F. Rupp, K. Chevalier, M. M. N. Wolf, H. -J. Krüger, C. v. Wüllen, Y. Nosenko, G. Niedner-Schatteburg, C. Riehn, R. Diller

Photoinduced Processes in Cobalt-Complexes: Condensed Phase and Gas Phase.

EPJ Web of Conf. 2013, 41, 05045.



T. Jozak, Y. Sun, Y. Schmitt, S. Lebedkin, M. Kappes, M. Gerhards and W. R. Thiel

New Hexanuclear Group 11 Pyrazolate Complexes: Synthesis and Photophysical Features

Chem.Eur.J. 2011, 17, 3384-3389.



M. Arndt, K. S. M. Salih, A. Fromm, L. J. Goossen, F. Menges, G. Niedner-Schatteburg

Mechanistic Investigation of the Ru-Catalyzed Hydroamidation of Terminal Alkynes

J. Am. Chem. Soc. 2011, 133, 7428–7449.



M. M. N. Wolf, H. Zimmermann, R. Diller, T. Domratcheva

Vibrational Mode Analysis of Isotope-Labeled Electronically Excited Riboflavin

J. Phys. Chem. B 2011, 115, 7621-7628.



C. K. Seubert, Y. Sun, Y. Lan, A. K. Powell, W. R. Thiel

From a Simple Pyrazole-Derived 1,2-Amino Alcohol to Mono- and Multinuclear Complexes by Tailoring Hydrogen Bond Patterns

Eur. J. Inorg. Chem. 2011, 1768–1775.



K. Muller, A. Schubert, T. Jozyk, A. Ahrens-Botzong, V. Schünemann, W.R. Thiel

Electronic Effects in the Catalytic Hydrosilylation with In-Situ Iron(II)-Catalysts

ChemCatChem 2011, 3, 887-892.



D. M. Zink, T. Grab, T. Baumann, M. Nieger, E. C. Barnes, W. Klopper, S. Bräse

Experimental and Theoretical Study of Novel Luminescent Di-,Tri-, and Tetranuclear Copper Triazole Complexes

Organometallics 2011, 30, 3275–3283.



S. Schmitt, P. Jost, C. van Wüllen

Zero-field splittings from density functional calculations: Analysis and improvement of known methods

J. Chem. Phys. 2011 , 134, 194113.



R. Gonzalez-Prieto, B. Fleury, F. Schramm, G. Zoppellaro, R. Chandrasekar, O. Fuhr, S. Lebedkin, M. Kappes, M. Ruben

Tuning the spin-transition properties of pyrene-decorated 2,6-bispyrazolylpyridine based Fe(II) complexes

Dalton Trans. 2011, 40, 7564.



M. Urdampilleta, S. Klyatskaya, J-P. Cleuziou, M. Ruben, W. Wernsdorfer

Supramolecular spin valves

Nature Materials 2011, 10, 502-506.



H. P. Nayek, N. Arleth, I. Trapp, M. Löble, P. Oña-Burgos, M. Kuzdrowska, Y. Lan, A.K. Powell, F. Breher, P. W. Roesky

Sodium and Potassium Salts of Mono- and Dianionic α-Iminopyridines

Chem. Eur. J. 2011, 17, 10814 – 10819.



B. Song, T. Himmler, L. J. Gooßen

Palladium/Copper-Catalyzed Di-α-arylation of Acetic Acid Esters

Adv. Synth. & Catal. 2011, 353, 1688–1694.



D. M. Zink, T. Baumann, M. Nieger, S. Bräse

Improved One-Pot Synthesis of C3-Symmetric ClickPhos and Related Ligands: Structures of Unique Triazole–Zinc Complexes

Eur. J. Org. Chem. 2011, 1432–1437.



F. Menges, C. Riehn, G. Niedner-Schatteburg

The Interaction of the Dipeptide Carnosine With Alkali Metal Ions Studied by Ion Trap Mass Spectrometry

Z. Phys. Chem. 2011, 225, 595-609.



C. Li, W. Jin, H. Xiang, G. Lefkidis, W. Hübner

Theory of laser-induced ultrafast magneto-optic spin flip and transfer in charged two-magnetic-center molecular ions: Role of bridging atoms

Phys. Rev. B 2011, 84, 054415(9).



V. Mereacre, A. Baniodeh, C. E. Anson, A. K. Powell

Effect of Ligand Substitution on the Interaction Between Anisotropic Dy(III) Ions and 57Fe Nuclei in Fe2Dy2 Coordination Clusters

J. Am. Chem. Soc. 2011, 133, 15335–15337.



B. Zimmermann, W. I. Dzik, T. Himmler, L. J. Goossen

Palladium-Catalyzed Cross-Coupling of Sterically Demanding Boronic
Acids with α-Bromocarbonyl Compounds

J. Org. Chem. 2011, 76, 8107–8112.



C. Schrenk, A. Kubas, K. Fink, A. Schnepf

[Sn4Si{Si(SiMe3)3}4{SiMe3}2]: A Model Compound for the Unexpected
First-Order Transition from a Singlet Biradicaloid to a Classical
Bonded Molecule

Angew. Chem. Int. Ed. 2011, 50, 7273 –7277.



A. Kubas, J. Hartung, K. Fink

How molecular oxygen binds to bis[trifluoroacetylacetonato(-1)]cobalt(II) – ab initio and density functional theory studies

Dalton Trans. 2011, 40, 11289-11295.



B. Murugesapandian, P. W. Roesky

Synthesis and Structures of Zinc(II) and Cadmium(II) Complexes with6-Benzenecarboxylate) Chromium Tricarbonyl and Pyrazole Derivatives

Z. Anorg. Allg. Chem. 2011, 637, 1818–1823.



D. Nied, P. Oña-Burgos, W. Klopper, F. Breher

Tuning the gap: Electronic properties and radical-type reactivities of heteronuclear [1.1.1]propellanes of heavier group 14 elements

Organometallics 2011, 30, 1419-1428.



W. I. Dzik, L. J. Gooßen

Selective Crossed-Tishchenko Reaction—AWaste-Free
Synthesis of Benzyl Esters

Angew. Chem. Int. Ed. 2011, 50, 11047 – 11049



S. Peredkov, M. Neeb, W. Eberhardt, J. Meyer, M. Tombers, H. Kampschulte, G. Niedner-Schatteburg
Spin and orbital magnetic moments of free nanoparticles

Phys. Rev. Lett. 2011, 107, 233401.



K. C. Mondal, G. E. Kostakis, Y. Lan, W. Wernsdorfer, C. E. Anson, A. K. Powell

Defect Dicubane Ni2Ln2 (Ln = Dy, Tb) Single Molecule Magnets

Inorg. Chem., 2011, 50 (22), pp 11604–11611.



K. D. Vogiatzis, W. Klopper, A. Mavrandonakis, K. Fink
Magnetic properties of paddlewheels and trinuclear clusters with exposed metal sites

ChemPhysChem 2011, 12, 3307 – 3319.



M. Kühn, F. Weigend
Phosphorescence Energies of Organic Light-Emitting Diodes from Spin-Flip Tamm–Dancoff Approximation Time-Dependent Density Functional Theory

ChemPhysChem 2011, 12, 3331– 3336.



L. T. Ghoochany, S. Farsadpour, Yu Sun, W. R. Thiel

New N,N,N-Donors Resulting in Highly Active Ruthenium Catalysts for Transfer Hydrogenation at Room Temperature

Eur. J. Inorg. Chem. 2011, 3431-3437.



S. Farsadpour, L. T. Ghoochany, Yu Sun, W. R. Thiel
Small Substituents Make Large Differences: Aminopyrimidinyl Phosphanes Undergoing C–H Activation

Eur. J. Inorg. Chem. 2011, 4603-4609.



F. C. Falk, R. Fröhlich, J. Paradies

Coupling of ortho-substituted aryl chlorides with bulky amides.

Chem. Commun. 2011,47, 11095-11097.



G. P. Zhang, W. Hübner, G. Lefkidis, Y. Bai, and T. F. George

Reply: Is the controversy over femtosecond magneto-optics really solved?

Nature Physics 2011, 7, 665.



F. Lauterwasser, P. G. Hayes, W. E. Piers, L. L. Schafer, S. Bräse

Highly Active and Diastereoselective N,O- and N,N-Yttrium Complexes for Intramolecular Hydroamination.

Adv. Synth. Catal. 2011, 353, 1384-1391.


G. Lefkidis, C. Li, G. Palz, M. Blug, H. Kelm, H.-J. Krüger, W. Hübner

Ab Initio Theory for Ultrafast Magnetic Local Spin Flip on the Newly Synthesized Homodinuclear Complex [NiII2(L-N4Me2)(emb)].

J. Phys. Chem. A 2011, 115, 1774–1780.