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The Journal of Physical Chemistry. B|July 24, 2018
How Meaningful Is the Halogen Bonding in 1-Ethyl-3-methyl Imidazolium-Based Ionic Liquids for CO2 Capture?Lucas Lodeiro, Renato Contreras, Rodrigo Ormazábal-Toledo
The Journal of Physical Chemistry. B|July 11, 2024
The Simulation of Solvent Polarizabilities and Dipolarities with Polarizable Continuum ModelRodrigo Ormazábal-Toledo, Marcos Caroli Rezende, Matías Vidal
The Journal of Organic Chemistry|June 27, 2020
Unraveling the Selectivity Patterns in Phosphine-Catalyzed Annulations of Azomethine Imines and AllenoatesSebastián Gallardo-Fuentes, Rodrigo Ormazábal-Toledo, Israel Fernández
Organic Letters|January 18, 2011
Are electrophilicity and electrofugality related concepts? A density functional theory studyRodrigo Ormazábal-Toledo, Paola R Campodónico, Renato Contreras
The Journal of Organic Chemistry|January 8, 2013
Reactivity indices profile: a companion tool of the potential energy surface for the analysis of reaction mechanisms. Nucleophilic aromatic substitution reactions as test caseRodrigo Ormazábal-Toledo, Renato Contreras, Paola R Campodónico
The Journal of Physical Chemistry. B|September 26, 2015
Lewis Acidity/Basicity Changes in Imidazolium Based Ionic Liquids Brought About by ImpuritiesMarcela Gazitúa, Patricio Fuentealba, Renato Contreras, et al.
The Journal of Physical Chemistry. A|July 30, 2025
In Silico Estimation of Solvent Polarizabilities and DipolaritiesMarcos Caroli Rezende, Nicolás Rozas-Castro, Rodrigo Ormazábal-Toledo
Physical Chemistry Chemical Physics : PCCP|January 13, 2021
On the role of water in the hydrogen bond network in DESs: an ab initio molecular dynamics and quantum mechanical study on the urea-betaine systemRenato Contreras, Lucas Lodeiro, Nicolás Rozas-Castro, et al.
Organic & Biomolecular Chemistry|November 12, 2019
Theoretical insights into the E1cB/E2 mechanistic dichotomy of elimination reactionsDaniela E Ortega, Rodrigo Ormazábal-Toledo, Renato Contreras, et al.
Organic & Biomolecular Chemistry|February 21, 2013
Specific nucleophile-electrophile interactions in nucleophilic aromatic substitutionsRodrigo Ormazábal-Toledo, Renato Contreras, Ricardo A Tapia, et al.
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