Publicaciones en las que colabora con VERONICA POSTILS RIBO (10)

2022

  1. Can aluminum, a non-redox metal, alter the thermodynamics of key biological redox processes? The DPPH-QH2 radical scavenging reaction as a test case

    Free Radical Biology and Medicine, Vol. 179, pp. 200-207

  2. Generation of multiple triplet states in an orthogonal bodipy dimer: a breakthrough spectroscopic and theoretical approach

    Physical chemistry chemical physics : PCCP, Vol. 24, Núm. 10, pp. 5929-5938

2021

  1. Mild Open-Shell Character of BODIPY and Its Impact on Singlet and Triplet Excitation Energies

    Journal of Chemical Theory and Computation, Vol. 17, Núm. 9, pp. 5825-5838

2020

  1. Efficient alkene hydrosilation with bis(8-quinolyl)phosphine (NPN) nickel catalysts. The dominant role of silyl-over hydrido-nickel catalytic intermediates

    Chemical Science, Vol. 11, Núm. 19, pp. 5043-5051

2019

  1. Fluoreno[2,1-a] fluorene: An ortho -naphthoquinodimethane-based system with partial diradical character

    Chemical Communications, Vol. 55, Núm. 94, pp. 14186-14189

2018

  1. An Objective Alternative to IUPAC's Approach To Assign Oxidation States

    Angewandte Chemie - International Edition, Vol. 57, Núm. 33, pp. 10525-10529

  2. Mechanism of the Selective Fe-Catalyzed Arene Carbon-Hydrogen Bond Functionalization

    ACS Catalysis, Vol. 8, Núm. 5, pp. 4313-4322

  3. Metal Cluster Electrides: A New Type of Molecular Electride with Delocalised Polyattractor Character

    Chemistry - A European Journal, Vol. 24, Núm. 39, pp. 9853-9859

  4. Quantum mechanics/molecular mechanics studies on the relative reactivities of compound I and II in cytochrome p450 enzymes

    International Journal of Molecular Sciences, Vol. 19, Núm. 7

2015

  1. Oxidation states from wave function analysis

    Journal of Chemical Theory and Computation, Vol. 11, Núm. 4, pp. 1501-1508