Journal Article (5188)
2025
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Demirbas, D.; ; ; ; ; ; Easing Intermediates Search by Combining Spectroscopy and Multivariate Curve Reconstruction: [CuI(6,6′-Dimethyl-2,2′-Bipyridyl)2]PF6 Oxidation as Case Study. The Journal of Physical Chemistry Letters 2025, 16, 1652–1659.
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Bengsch, M.; Neumann, C. N. Metal-Organic Framework–Specific Catalysis. ChemCatChem 2025, e202402102.
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van Gastel, M.; ; ; ; ; Activation of Electrophilic Reactivity by Protonation and Oxidation of a Peroxo CoIIICoIII Complex: Reactivity and Molecular Structures of Hydroperoxo, Superoxo, and Peroxo CoIIICoIII Complexes. Journal of the American Chemical Society 2025, 147, 5775–5784.
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Stamoulis, A.; Mato, M.; ; Leutzsch, M.; ; ; Neese, F.; Cornella, J. Red-Light-Active N,C,N-Pincer Bismuthinidene: Excited State Dynamics and Mechanism of Oxidative Addition into Aryl Iodides. Journal of the American Chemical Society 2025, 147, 6037–6048.
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Saeb, R.; Roh, B.; Cornella, J. “Naked Nickel”-Catalyzed Heteroaryl–Heteroaryl Suzuki–Miyaura Coupling. Angewandte Chemie International Edition 2025, e202424051.
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Marlow, F.; Microscopic and Spectroscopic Investigation of Deposited Thin Opal Films Using an Electric Field Assisted Capillary Deposition Method. ScienceAsia 2025, 51, 2025004.
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Kayal, R.; ; Harden, I.; Neese, F.; Bistoni, G. Understanding and Quantifying the Impact of Solute–Solvent Van der Waals Interactions on the Selectivity of Asymmetric Catalytic Transformations. Chemical Science 2025, 16, 2700–2709.
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Feliciano, G. T.; Auer, A. A. Toward Explicit Solvation for Simulations of Electrocatalytic Reactions: AIMD for PKa and Redox Potentials of Transition Metal Compounds and Catalyst Models. The Journal of Physical Chemistry A 2025, 129, 1757–1768.
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Molina Betancourt, R.; Leutzsch, M.; Fürstner, A. Total Synthesis of the Marine Diterpenoids Caucanolide E and F by Alkyne Gem-Hydrogenation: Rigorous Reassignment of Two Almost Indistinguishable Diastereomers. Angewandte Chemie International Edition 2025, e202500124.
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van der Worp, B. A.; Ritter, T. N-Protonated Acridinium Catalyst Enables Anti-Markovnikov Hydration of Unconjugated Tri- and Disubstituted Olefins. Journal of the American Chemical Society 2025, 147, 4736–4742.
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Casanova-Páez, M.; Neese, F. Core-Excited States for Open-Shell Systems in Similarity-Transformed Equation-of-Motion Theory. Journal of Chemical Theory and Computation 2025, 21, 1306–1321.
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Petersen, H.; Stegmann, N.; Schmidt, W.; Weidenthaler, C. Investigating the Reductive Phosphatization Reaction Pathway in the Synthesis of Transition Metal Phosphates: A Case Study on Titanium Phosphates. Inorganic Chemistry 2025, 64, 2425–2432.
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Santra, G. Revisiting Boron Cluster Dihydrogen Bonding: Improved Reference Energies and Benchmark of Localized Coupled Cluster and DFT Methods. ChemRxiv: the Preprint Server for Chemistry 2025.
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Marlow, F.; Koehler, T.; ; A Hidden Chemical Assembly Mechanism: Reconstruction-by-Reconstruction Cycle Growth in HKUST-1 MOF Layer Synthesis. ChemPhysChem 2025, e202400968.
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Ahmadli, D.; Müller, S.; Xie, Y.; ; ; ; ; Ritter, T. Standardized Approach for Diversification of Complex Small Molecules Via Aryl Thianthrenium Salts. Journal of the American Chemical Society 2025, 147, 4268–4283.
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Garcia-Padilla, E.; Qiu, G. Global Kinetic-Thermodynamic Responses: Derivation of a General Non-Linear Equation and Demonstrations on Chemical Reactions. ChemRxiv: the Preprint Server for Chemistry 2025.
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Whitehurst, W. G.; Schulte, T.; Wang, Z.; Waldbach, F.; Ritter, T. Arene Ring Expansion by Ruthenium η6-Arene Complexes. Angewandte Chemie International Edition 2025, 64, e202421608.
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Spinnato, D.; Nöthling, N.; Leutzsch, M.; van Gastel, M.; Wagner, L.; Neese, F.; Cornella, J. A Trimetallic Bismuth(I)-Based Allyl Cation. Nature Chemistry 2025, 17, 265–270.
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van Gastel, M.; ; Understanding the P-Cluster of Vanadium Nitrogenase: an EPR and XAS Study of the Holo Vs. Apo Forms of the Enzyme. ChemBioChem: A European Journal of Chemical Biology 2025, 26, e202400833.
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Li, L.; Müller, S.; Petzold, R.; Ritter, T. Late-Stage Diazoester Installation Via Arylthianthrenium Salts. Angewandte Chemie International Edition 2025, 64, e202419931.