Wissenschaftliche Publikationen

Bhattacharjee, S.; Neese, F.; Pantazis, D. A.: Triplet states in the reaction center of Photosystem II. Chemical Science 14 (35), S. 9503 - 9516 (2023)

Harbor-Collins, H.; Sabba, M.; Moustafa, G.; Legrady, B.; Soundararajan, M.; Leutzsch, M.; Levitt, M. H.: The ¹⁰³Rh NMR spectroscopy and relaxometry of the rhodium formate paddlewheel complex. The Journal of Chemical Physics 159 (10), 104307 (2023)

Reetz, M. T.; Hollmann, F.: Breakthrough in the challenging P450-catalyzed chemoenzymatic synthesis of C14-functionalized steroids. Science China Chemistry 66 (9), S. 2435 - 2436 (2023)

Hall, K. R.; Joseph, C.; Ayuso-Fernández, I.; Tamhankar, A.; Rieder, L.; Skaali, R.; Golten, O.; Neese, F.; Røhr, Å. K.; Jannuzzi, S. A. V. et al.; DeBeer, S.; Eijsink, V. G. H.; Sørlie, M.: A Conserved Second Sphere Residue Tunes Copper Site Reactivity in Lytic Polysaccharide Monooxygenases. Journal of the American Chemical Society 145 (34), S. 18888 - 18903 (2023)

Mato, M.; Bruzzese, P. C.; Takahashi, F.; Leutzsch, M.; Reijerse, E. J.; Schnegg, A.; Cornella, J.: Oxidative Addition of Aryl Electrophiles into a Red-Light-Active Bismuthinidene. Journal of the American Chemical Society 145 (34), S. 18742 - 18747 (2023)

Beyazay, T.; Martin, W. F.; Tüysüz, H.: Direct Synthesis of Formamide from CO₂ and H₂O with Nickel–Iron Nitride Heterostructures under Mild Hydrothermal Conditions. Journal of the American Chemical Society (2023)

Li, L.; Vozniuk, O.; Cao, Z.; Losch, P.; Felderhoff, M.; Schüth, F.: Hydrogenation of different carbon substrates into light hydrocarbons by ball milling. Nature Communications 14, 5257 (2023)

Lindner, M. M.; Alachraf, M. W.; Mitschke, B.; Schulze, P.; Leutzsch, M.; List, B.: Toward a Formyl-to-Phenyl Conversion: An Unexpected Photochemical Fulvene-Rearrangement. Angewandte Chemie International Edition 62 (35), e202303119 (2023)

Schwengers, S. A.; Gerosa, G. G.; Amatov, T.; Yasukawa, N.; Brunen, S.; Leutzsch, M.; Mitschke, B.; Shevchenko, G. A.; List, B.: Direct Regioselective Dehydrogenation of α-Substituted Cyclic Ketones. Angewandte Chemie International Edition 62 (35), e202307081 (2023)

Shafei, R.; Hamano, A.; Gourlaouen, C.; Maganas, D.; Takano, K.; Daniel, C.; Neese, F.: Theoretical spectroscopy for unraveling the intensity mechanism of the optical and photoluminescent spectra of chiral Re(I) transition metal complexes. The Journal of Chemical Physics 159 (8), 084102 (2023)

Ansari, M. A.; Ansari, M.; Pandey, M. K.; Köhler, C.; Herbst-Irmer, R.; Stalke, D.; Roesky, H. W.: Diverse Reactivity of bis(Silylene) and bis(Germylene) [LE−EL (E=Si and Ge: L=PhC(NtBu)₂)] in the Oxidative Activation of C−F Bond: Si−Si Bond is Retained While the Ge−Ge Bond Is Cleaved. European Journal of Inorganic Chemistry 26 (24), e202300209 (2023)

Stylianakis, I.; Zervos, N.; Lii, J.-H.; Pantazis, D. A.; Kolocouris, A.: Conformational energies of reference organic molecules: benchmarking of common efficient computational methods against coupled cluster theory. Journal of Computer-Aided Molecular Design (2023)

Tran, V. A.; Teucher, M.; Galazzo, L.; Sharma, B.; Pongratz, T.; Kast, S. M.; Marx, D.; Bordignon, E.; Schnegg, A.; Neese, F.: Dissecting the Molecular Origin of g-Tensor Heterogeneity and Strain in Nitroxide Radicals in Water: Electron Paramagnetic Resonance Experiment versus Theory. The Journal of Physical Chemistry A 127 (31), S. 6447 - 6466 (2023)

Pang, Y.; Leutzsch, M.; Nöthling, N.; Cornella, J.: Dihydrogen and Ethylene Activation by a Sterically Distorted Distibene. Angewandte Chemie International Edition 62 (32), e202302071 (2023)

Yang, X.; Kuziola, J.; Béland, V. A.; Busch, J.; Leutzsch, M.; Burés, J.; Cornella, J.: Bismuth-Catalyzed Amide Reduction. Angewandte Chemie International Edition 62 (32), e202306447 (2023)

Seidel, R. W.; Goddard, R.; Nöthling, N.; Kolev, T. M.: On the structures of free-base lepidine and some mineral acid salts. Journal of Molecular Structure 1285, 135460 (2023)

Fürstner, A.: How to Break the Law: trans-Hydroboration and gem-Hydroboration of Alkynes. Israel Journal of Chemistry 63 (7-8), e202300004 (2023)

Li, S.; Zhou, H.; List, B.: Synthesis and Resolution of an Axially Chiral Spirocyclic Quaternary Ammonium Ion-Based Phase-Transfer Catalyst. Asian Journal of Organic Chemistry 12 (8), e202300241 (2023)

Mato, M.; Spinnato, D.; Leutzsch, M.; Moon, H. W.; Reijerse, E. J.; Cornella, J.: Bismuth radical catalysis in the activation and coupling of redox-active electrophiles. Nature Chemistry 15 (8), S. 1138 - 1145 (2023)

Reetz, M. T.: Dyotropic Rearrangements in Organic Solvents, in the Gas Phase, and in Enzyme Catalysis. Israel Journal of Chemistry 63 (7-8), e202200122 (2023)