Publications by authors named "Veronica Postils"

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Isolable monoatomic monovalent bismuth complexes with a redox non-innocent bis-silylenyl carborane ligand.
Jian Xu, Shenglai Yao, Verònica Postils, Eduard Matito, Christian Lorent

Chem Sci· June 2025

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Second-order nonlinear optical properties of X-shaped pyrazine derivatives.
Verònica Postils, Zuzana Burešová, David Casanova, Benoît Champagne, Filip Bureš

Phys Chem Chem Phys· January 2024

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Generation of multiple triplet states in an orthogonal bodipy dimer: a breakthrough spectroscopic and theoretical approach.
Inmaculada García-Moreno, Verònica Postils, Esther Rebollar, Maria J Ortiz, Antonia R Agarrabeitia

Phys Chem Chem Phys· March 2022

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Can aluminum, a non-redox metal, alter the thermodynamics of key biological redox processes? The DPPH-QH radical scavenging reaction as a test case.
Jose Lanuza, Verònica Postils, Xabier Lopez

Free Radic Biol Med· February 2022

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Mild Open-Shell Character of BODIPY and Its Impact on Singlet and Triplet Excitation Energies.
Verònica Postils, Fernando Ruipérez, David Casanova

J Chem Theory Comput· September 2021

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Efficient alkene hydrosilation with bis(8-quinolyl)phosphine (NPN) nickel catalysts. The dominant role of silyl-over hydrido-nickel catalytic intermediates.
Jian Yang, Verònica Postils, Michael I Lipschutz, Meg Fasulo, Christophe Raynaud

Chem Sci· April 2020

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Fluoreno[2,1-a]fluorene: an ortho-naphthoquinodimethane-based system with partial diradical character.
Allison S Hacker, Mauricio Pavano, James E Wood, Hannah Hashimoto, Kyle M D'Ambrosio, Verònica Postils

Chem Commun (Camb)· December 2019

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An Objective Alternative to IUPAC's Approach To Assign Oxidation States.
Verònica Postils, Carlos Delgado-Alonso, Josep M Luis, Pedro Salvador

Angew Chem Int Ed Engl· August 2018

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Metal Cluster Electrides: A New Type of Molecular Electride with Delocalised Polyattractor Character.
Ouissam El Bakouri, Verònica Postils, Marc Garcia-Borràs, Miquel Duran, Josep M Luis

Chemistry· July 2018

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Quantum Mechanics/Molecular Mechanics Studies on the Relative Reactivities of Compound I and II in Cytochrome P450 Enzymes.
Verònica Postils, Maud Saint-André, Amy Timmins, Xiao-Xi Li, Yong Wang

Int J Mol Sci· July 2018

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Reactivity Patterns of (Protonated) Compound II and Compound I of Cytochrome P450: Which is the Better Oxidant?
Xiao-Xi Li, Verònica Postils, Wei Sun, Abayomi S Faponle, Miquel Solà

Chemistry· May 2017

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Iron and Manganese Catalysts for the Selective Functionalization of Arene C(sp(2) )-H Bonds by Carbene Insertion.
Ana Conde, Gerard Sabenya, Mònica Rodríguez, Verònica Postils, Josep M Luis

Angew Chem Int Ed Engl· May 2016

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Computational Insight into the Mechanism of Alkane Hydroxylation by Non-heme Fe(PyTACN) Iron Complexes. Effects of the Substrate and Solvent.
Verònica Postils, Anna Company, Miquel Solà, Miquel Costas, Josep M Luis

Inorg Chem· September 2015

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Oxidation States from Wave Function Analysis.
Eloy Ramos-Cordoba, Verònica Postils, Pedro Salvador

J Chem Theory Comput· April 2015

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On the existence and characterization of molecular electrides.
Verònica Postils, Marc Garcia-Borràs, Miquel Solà, Josep M Luis, Eduard Matito

Chem Commun (Camb)· March 2015

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The mechanism of stereospecific C-H oxidation by Fe(Pytacn) complexes: bioinspired non-heme iron catalysts containing cis-labile exchangeable sites.
Irene Prat, Anna Company, Verònica Postils, Xavi Ribas, Lawrence Que

Chemistry· May 2013

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