Publications of the MPI für Kohlenforschung

Chilkuri, V. G.; Neese, F. Comparison of Many‐Particle Representations for Selected‐CI I: A Tree Based Approach. Journal of Computational Chemistry 2021, 42, 982–1005.

Sun, X.; Ritter, T. Decarboxylative Polyfluoroarylation of Alkylcarboxylic Acids. Angewandte Chemie International Edition 2021, 60, 10557–10562.

Orio, M.; Pantazis, D. A. Successes, Challenges, and Opportunities for Quantum Chemistry in Understanding Metalloenzymes for Solar Fuels Research. Chemical Communications 2021, 57, 3952–3974.

Willems, S.; Toupalas, G.; Reisenbauer, J. C.; Morandi, B. A Site-Selective and Stereospecific Cascade Suzuki–Miyaura Annulation of Alkyl 1,2-Bisboronic Esters and 2,2′-Dihalo 1,1′-Biaryls. Chemical Communications 2021, 57, 3909–3912.

Dai, Y.; Tüysüz, H. Rapid Acidic Media Growth of Cs₃Bi₂Br₉ Platelets for Photocatalytic Toluene Oxidation. Solar RRL 2021.

Amrute, A. P.; de Bellis, J.; Felderhoff, M.; Schüth, F. Mechanochemical Synthesis of Catalytic Materials. Chemistry – A European Journal 2021, 27, 6819–6847.

Haack, A.; Hillenbrand, J.; Leutzsch, M.; van Gastel, M.; Neese, F.; Fürstner, A. Productive Alkyne Metathesis with “Canopy Catalysts” Mandates Pseudorotation. Journal of the American Chemical Society 2021, 143, 5643–5648.

Singha, S.; Buchsteiner, M.; Bistoni, G.; Goddard, R.; Fürstner, A. A New Ligand Design Based on London Dispersion Empowers Chiral Bismuth–Rhodium Paddlewheel Catalysts. Journal of the American Chemical Society 2021, 143, 5666–5673.

Bodach, A.; Nöthling, N.; Felderhoff, M. Activation of Molecular Hydrogen by Inter‐ and Intramolecular Al−N Lewis Pairs. European Journal of Inorganic Chemistry 2021, 2021, 1240–1243.

Lee, J.; Tüysüz, H. In‐Depth Comparative Study of Cathode Interfacial Layer for Stable Inverted Perovskite Solar Cell. ChemSusChem 2021.

Falk, T.; Budiyanto, E.; Dreyer, M.; Pflieger, C.; Waffel, D.; Büker, J.; Weidenthaler, C.; Ortega, K. F.; Behrens, M.; Tüysüz, H.; Muhler, M.; Peng, B. Identification of Active Sites in the Catalytic Oxidation of 2‐Propanol over Co_1+xFe_2‐xO₄ Spinel Oxides at Solid/Liquid and Solid/Gas Interfaces. ChemCatChem 2021.

Bodach, A.; Bernert, T.; Fischer, M.; Ley, M. B.; Weidenthaler, C. Polymorphism of di­Methyl­Amino­Borane N(CH₃)₂-BH₂. Acta Crystallographica Section B 2021, 77, 299–306.

Herlé, B.; Späth, G.; Schreyer, L.; Fürstner, A. Total Synthesis of Mycinolide IV and Path‐Scouting for Aldgamycin N. Angewandte Chemie International Edition 2021, 60, 7893–7899.

Späth, G.; Fürstner, A. Scalable De Novo Synthesis of Aldgarose and Total Synthesis of Aldgamycin N. Angewandte Chemie International Edition 2021, 60, 7900–7905.

Sharma, M. K.; Rottschäfer, D.; Neumann, B.; Stammler, H.-G.; Danés, S.; Andrada, D. M.; van Gastel, M.; Hinz, A.; Ghadwal, R. S. Metalloradical Cations and Dications Based on Divinyldiphosphene and Divinyldiarsene Ligands. Chemistry – A European Journal 2021, 27, 5803–5809.

Huang, L.; Bismuto, A.; Rath, S. A.; Trapp, N.; Morandi, B. Ruthenium‐Catalyzed Dehydrogenation Through an Intermolecular Hydrogen Atom Transfer Mechanism. Angewandte Chemie International Edition 2021, 60, 7290–7296.

Monkcom, E. C.; de Bruin, D.; de Vries, A. J.; Lutz, M.; Ye, S.; Klein Gebbink, R. J. M. Structurally Modelling the 2‐His‐1‐Carboxylate Facial Triad with a Bulky N,N,O Phenolate Ligand. Chemistry – A European Journal 2021, 27, 5191–5204.

Acevedo-Rocha, C. G.; Li, A.; D'Amore, L.; Hoebenreich, S.; Sanchis, J.; Lubrano, P.; Ferla, M. P.; Garcia-Borràs, M.; Osuna, S.; Reetz, M. T. Pervasive Cooperative Mutational Effects on Multiple Catalytic Enzyme Traits Emerge Via Long-Range Conformational Dynamics. Nature Communications 2021, 12.

Zhu, C.; Mandrelli, F.; Zhou, H.; Maji, R.; List, B. Catalytic Asymmetric Synthesis of Unprotected β²-Amino Acids. Journal of the American Chemical Society 2021, 143, 3312–3317.

Ouyang, J.; Bae, H.; Jordi, S.; Dao, Q. M.; Dossenbach, S.; Dehn, S.; Lingnau, J. B.; De, C. K.; Kraft, P.; List, B. The Smelling Principle of Vetiver Oil, Unveiled by Chemical Synthesis. Angewandte Chemie International Edition 2021, 60, 5666–5672.