Miquel Solà

Research interests

Publications

• Aromaticity: Quo Vadis

  Chemical Science · 2023 · https://doi.org/10.1039/d2sc04998h

• Mechanistic Studies of Transition-Metal-Catalyzed [2 + 2 + 2] Cycloaddition Reactions

  Chemical Reviews · 2020 · 10.1021/acs.chemrev.0c00062

• Too Persistent to Give Up: Aromaticity in Boron Clusters Survives Radical Structural Changes

  Journal of the American Chemical Society · 2020 · 10.1021/jacs.0c02228

• Nine questions on energy decomposition analysis

  Journal of Computational Chemistry · 2019 · https://doi.org/10.1002/jcc.26003

• Why Aromaticity Is a Suspicious Concept? Why?

  Frontiers in Chemistry · 2017 · 10.3389/fchem.2017.00022

• The electron density of delocalized bonds (EDDB) applied for quantifying aromaticity

  Physical Chemistry Chemical Physics · 2017 · 10.1039/c7cp06114e

• Quantifying aromaticity with electron delocalisation measures

  Chemical Society Reviews · 2015 · https://doi.org/10.1039/c5cs00066a

• π Aromaticity and Three‐Dimensional Aromaticity: Two sides of the Same Coin?

  Angewandte Chemie International Edition · 2014 · 10.1002/anie.201407359

• Forty years of Clar's aromatic π-sextet rule

  Frontiers in Chemistry · 2013 · https://doi.org/10.3389/fchem.2013.00022

• Nucleophilic Aryl Fluorination and Aryl Halide Exchange Mediated by a CuI/CuIII Catalytic Cycle

  Journal of the American Chemical Society · 2011 · 10.1021/ja2058567

• Facile C−H Bond Cleavage via a Proton-Coupled Electron Transfer Involving a C−H···CuIIInteraction

  Journal of the American Chemical Society · 2010 · https://doi.org/10.1021/ja101599e

• A Critical Assessment of the Performance of Magnetic and Electronic Indices of Aromaticity

  Symmetry · 2010 · https://doi.org/10.3390/sym2021156

• On the performance of some aromaticity indices: A critical assessment using a test set

  Journal of Computational Chemistry · 2008 · 10.1002/jcc.20914

• The role of electronic delocalization in transition metal complexes from the electron localization function and the quantum theory of atoms in molecules viewpoints

  Coordination Chemistry Reviews · 2008 · 10.1016/j.ccr.2008.10.003

• Polycyclic Benzenoids: Why Kinked is More Stable than Straight

  The Journal of Organic Chemistry · 2007 · 10.1021/jo061637p

• Hydrogen–Hydrogen Bonding in Planar Biphenyl, Predicted by Atoms‐In‐Molecules Theory, Does Not Exist

  Chemistry - A European Journal · 2006 · 10.1002/chem.200500850

• Electron sharing indexes at the correlated level. Application to aromaticity calculations

  Faraday Discussions · 2006 · 10.1039/b605086g

• A Model of the Chemical Bond Must Be Rooted in Quantum Mechanics, Provide Insight, and Possess Predictive Power

  Chemistry - A European Journal · 2006 · 10.1002/chem.200600057

• Nucleus-independent chemical shift (NICS) profiles in a series of monocyclic planar inorganic compounds

  Journal of Organometallic Chemistry · 2006 · https://doi.org/10.1016/j.jorganchem.2006.01.038

• Fine‐Tuning the Electronic Properties of Highly Stable Organometallic CuIII Complexes Containing Monoanionic Macrocyclic Ligands

  Chemistry - A European Journal · 2005 · https://doi.org/10.1002/chem.200500088

• Chemical bonding in transition metal carbene complexes

  Journal of Organometallic Chemistry · 2005 · https://doi.org/10.1016/j.jorganchem.2005.08.054

• Local Aromaticity of [n]Acenes, [n]Phenacenes, and [n]Helicenes (n= 1−9)

  The Journal of Organic Chemistry · 2005 · 10.1021/jo0480388

• Comparison of the AIM Delocalization Index and the Mayer and Fuzzy Atom Bond Orders

  The Journal of Physical Chemistry A · 2005 · 10.1021/jp0538464

• Theoretical Evaluation of Electron Delocalization in Aromatic Molecules by Means of Atoms in Molecules (AIM) and Electron Localization Function (ELF) Topological Approaches

  Chemical Reviews · 2005 · https://doi.org/10.1021/cr030085x

• Relation between the Substituent Effect and Aromaticity

  The Journal of Organic Chemistry · 2004 · 10.1021/jo0492113

• The aromatic fluctuation index (FLU): A new aromaticity index based on electron delocalization

  The Journal of Chemical Physics · 2004 · https://doi.org/10.1063/1.1824895

• The Delocalization Index as an Electronic Aromaticity Criterion: Application to a Series of Planar Polycyclic Aromatic Hydrocarbons

  Chemistry - A European Journal · 2003 · https://doi.org/10.1002/chem.200390041

• The calculation of electron localization and delocalization indices at the Hartree-Fock, density functional and post-Hartree-Fock levels of theory

  Theoretical Chemistry Accounts · 2002 · 10.1007/s00214-002-0356-8

• Electron-pairing analysis from localization and delocalization indices in the framework of the atoms-in-molecules theory

  Theoretical Chemistry Accounts · 2002 · 10.1007/s00214-002-0375-5

• Theoretical Studies of Some Transition-Metal-Mediated Reactions of Industrial and Synthetic Importance

  Chemical Reviews · 2000 · https://doi.org/10.1021/cr980452i

Current projects

No projects listed.