Publicaciones en colaboración con investigadores/as de Barcelona Institute for Science and Technology (16)

2021

  1. Consecutive Ligand-Based Electron Transfer in New Molecular Copper-Based Water Oxidation Catalysts

    Angewandte Chemie - International Edition, Vol. 60, Núm. 34, pp. 18639-18644

2019

  1. Computational characterization of single-electron transfer steps in water oxidation

    Inorganics, Vol. 7, Núm. 3

  2. Copper-Catalyzed N−F Bond Activation for Uniform Intramolecular C−H Amination Yielding Pyrrolidines and Piperidines

    Angewandte Chemie - International Edition, Vol. 58, Núm. 26, pp. 8912-8916

  3. Enantioselective Synthesis of 3-Heterosubstituted-2-amino-1-ols by Sequential Metal-Free Diene Aziridination/Kinetic Resolution

    Chemistry - A European Journal, Vol. 25, Núm. 54, pp. 12628-12635

  4. Four Oxidation States in a Single Photoredox Nickel-Based Catalytic Cycle: A Computational Study

    Angewandte Chemie - International Edition, Vol. 58, Núm. 12, pp. 3898-3902

  5. GARLEEK: Adding an extra flavor to ONIOM

    Journal of Computational Chemistry, Vol. 40, Núm. 2, pp. 381-386

  6. The Role of Electron-Donor Substituents in the Family of OPBAN-Cu Water Oxidation Catalysts: Effect on the Degradation Pathways and Efficiency

    European Journal of Inorganic Chemistry, Vol. 2019, Núm. 15, pp. 2109-2114

2018

  1. Accelerated Ru–Cu Trinuclear Cooperative C−H Bond Functionalization of Carbazoles: A Kinetic and Computational Investigation

    Chemistry - A European Journal, Vol. 24, Núm. 57, pp. 15178-15184

  2. Computational Characterization of the Mechanism for the Oxidative Coupling of Benzoic Acid and Alkynes by Rhodium/Copper and Rhodium/Silver Systems

    Chemistry - A European Journal, Vol. 24, Núm. 47, pp. 12383-12388

  3. Elucidating the Mechanism of Aryl Aminations Mediated by NHC-Supported Nickel Complexes: Evidence for a Nonradical Ni(0)/Ni(II) Pathway

    ACS Catalysis, Vol. 8, Núm. 5, pp. 3733-3742

  4. Enantioselective Synthesis of Aminodiols by Sequential Rhodium-Catalysed Oxyamination/Kinetic Resolution: Expanding the Substrate Scope of Amidine-Based Catalysis

    Chemistry - A European Journal, Vol. 24, Núm. 18, pp. 4635-4642

  5. Oxidative Coupling Mechanisms: Current State of Understanding

    ACS Catalysis, Vol. 8, Núm. 2, pp. 1161-1172

  6. Palladium-Catalyzed Aerobic Homocoupling of Alkynes: Full Mechanistic Characterization of a More Complex Oxidase-Type Behavior

    ACS Catalysis, Vol. 8, Núm. 8, pp. 7495-7506

2017

  1. Halide Abstraction Competes with Oxidative Addition in the Reactions of Aryl Halides with [Ni(PMenPh(3−n))4]

    Chemistry - A European Journal, Vol. 23, Núm. 66, pp. 16728-16733

  2. Single Electron Transfer Steps in Water Oxidation Catalysis. Redefining the Mechanistic Scenario

    ACS Catalysis, Vol. 7, Núm. 3, pp. 1712-1719

2016

  1. Cooperative Reductive Elimination: The Missing Piece in the Oxidative-Coupling Mechanistic Puzzle

    Angewandte Chemie - International Edition, Vol. 55, Núm. 8, pp. 2764-2767