Lista de obras - Jesús Jover - Dominio Público Uruguay

A Pseudo-Octahedral Cobalt(II) Complex with bis-Pyrazolylpyridine Ligands Acting as a Zero-Field Single-Molecule Magnet with Easy Axis Anisotropy

artículo científico publicado en 2018

A combined kinetico-mechanistic and computational study on the competitive formation of seven- versus five-membered platinacycles; the relevance of spectator halide ligands

scientific article published on 24 September 2015

A comparison of the binding affinity of the common amino acids with different metal cations.

artículo científico publicado en 2008

A computational study of phosphine ligand effects in Suzuki–Miyaura coupling☆

Accurate modelling of Pd(0) + PhX oxidative addition kinetics ⬇️

artículo científico publicado el 20 de octubre de 2010

Ammonia-Borane Derived BN Fragments Trapped on Bi- and Trimetallic Titanium(III) Systems

artículo científico publicado en 2019

Antiferro- to ferromagnetic crossover in diphenoxido bridged Ni II 2 Mn II complexes derived from N 2 O 2 donor Schiff base ligands

Bifunctional Tripeptide with a Phosphonic Acid as a Brønsted Acid for Michael Addition: Mechanistic Insights

artículo científico publicado en 2017

Computational assessment on the Tolman cone angles for P-ligands

scientific article published on 01 October 2019

Computational characterization of a mechanism for the copper-catalyzed aerobic oxidative trifluoromethylation of terminal alkynes

artículo científico publicado en 2013

Computational characterization of the mechanism for coinage-metal-catalyzed carboxylation of terminal alkynes

artículo científico publicado en 2014

Determination of Abraham solute parameters from molecular structure

artículo científico publicado en 2004

Determination of lithium cation basicity from molecular structure

artículo científico publicado en 2004

Expansion of the Ligand Knowledge Base for Chelating P,P-Donor Ligands (LKB-PP).

artículo científico publicado en 2012

Expansion of the Ligand Knowledge Base for Monodentate P-Donor Ligands (LKB-P)†

article published in 2010

Ferro- to Antiferromagnetic Crossover Angle in Diphenoxido- and Carboxylato-Bridged Trinuclear NiII2–MnII Complexes: Experimental Observations and Theoretical Rationalization

scientific article published on 11 August 2014

Investigation of easy-plane magnetic anisotropy in P-ligand square-pyramidal CoII single ion magnets

article by Amit Kumar Mondal et al published 2017 in Chemical Communications

Kineticomechanistic Study of the Redox pH Cycling Processes Occurring on a Robust Water-Soluble Cyanido-Bridged Mixed-Valence {CoIII/FeII}2 Square

artículo científico publicado en 2018

Magnetic Behavior of Heterometallic Wheels Having a [Mn(IV)6M2O9](10+) Core with M = Ca(2+) and Sr(2+).

artículo científico publicado en 2015

Modulation of single-molecule magnet behaviour via photochemical [2+2] cycloaddition

artículo científico publicado en 2015

Organometallic reactivity: the role of metal–ligand bond energies from a computational perspective ⬇️

artículo científico publicado el 19 de agosto de 2011

Quantitative DFT modeling of product concentration in organometallic reactions: Cu-mediated pentafluoroethylation of benzoic acid chlorides as a case study

artículo científico publicado en 2017

Quantitative structure-property relationship estimation of cation binding affinity of the common amino acids

artículo científico publicado en 2009

Ruthenium-Catalyzed O- to S-Alkyl Migration: A Pseudoreversible Barton-McCombie Pathway

artículo científico publicado en 2015

Screening substituent and backbone effects on the properties of bidentate P,P-donor ligands (LKB-PPscreen)

artículo científico publicado en 2013

Single-ion magnetic anisotropy in a vacant octahedral Co(ii) complex

scientific article published on 01 December 2018

Single-molecule magnetism arising from cobalt(ii) nodes of a crystalline sponge

scholarly article by Gabriel Brunet et al published 2017 in Journal of Materials Chemistry C

Slow relaxation of magnetization in a bis-mer-tridentate octahedral Co(ii) complex

artículo científico publicado en 2017

The Computational Road to Better Catalysts

article

The Newman-Kwart rearrangement of O-aryl thiocarbamates: substantial reduction in reaction temperatures through palladium catalysis

artículo científico publicado en 2009

Tunable Magnetization Dynamics through Solid-State Ligand Substitution Reaction.

artículo científico publicado en 2017

Lista de obras de Jesús Jover

A Pseudo-Octahedral Cobalt(II) Complex with bis-Pyrazolylpyridine Ligands Acting as a Zero-Field Single-Molecule Magnet with Easy Axis Anisotropy

A combined kinetico-mechanistic and computational study on the competitive formation of seven- versus five-membered platinacycles; the relevance of spectator halide ligands

A comparison of the binding affinity of the common amino acids with different metal cations.

A computational study of phosphine ligand effects in Suzuki–Miyaura coupling☆

Accurate modelling of Pd(0) + PhX oxidative addition kinetics ⬇️

Ammonia-Borane Derived BN Fragments Trapped on Bi- and Trimetallic Titanium(III) Systems

Antiferro- to ferromagnetic crossover in diphenoxido bridged Ni II 2 Mn II complexes derived from N 2 O 2 donor Schiff base ligands

Bifunctional Tripeptide with a Phosphonic Acid as a Brønsted Acid for Michael Addition: Mechanistic Insights

Computational assessment on the Tolman cone angles for P-ligands

Computational characterization of a mechanism for the copper-catalyzed aerobic oxidative trifluoromethylation of terminal alkynes

Computational characterization of the mechanism for coinage-metal-catalyzed carboxylation of terminal alkynes

Determination of Abraham solute parameters from molecular structure

Determination of lithium cation basicity from molecular structure

Expansion of the Ligand Knowledge Base for Chelating P,P-Donor Ligands (LKB-PP).

Expansion of the Ligand Knowledge Base for Monodentate P-Donor Ligands (LKB-P)†

Ferro- to Antiferromagnetic Crossover Angle in Diphenoxido- and Carboxylato-Bridged Trinuclear NiII2–MnII Complexes: Experimental Observations and Theoretical Rationalization

Investigation of easy-plane magnetic anisotropy in P-ligand square-pyramidal CoII single ion magnets

Kineticomechanistic Study of the Redox pH Cycling Processes Occurring on a Robust Water-Soluble Cyanido-Bridged Mixed-Valence {CoIII/FeII}2 Square

Magnetic Behavior of Heterometallic Wheels Having a [Mn(IV)6M2O9](10+) Core with M = Ca(2+) and Sr(2+).

Modulation of single-molecule magnet behaviour via photochemical [2+2] cycloaddition

Organometallic reactivity: the role of metal–ligand bond energies from a computational perspective ⬇️

Quantitative DFT modeling of product concentration in organometallic reactions: Cu-mediated pentafluoroethylation of benzoic acid chlorides as a case study

Quantitative structure-property relationship estimation of cation binding affinity of the common amino acids

Ruthenium-Catalyzed O- to S-Alkyl Migration: A Pseudoreversible Barton-McCombie Pathway

Screening substituent and backbone effects on the properties of bidentate P,P-donor ligands (LKB-PPscreen)

Single-ion magnetic anisotropy in a vacant octahedral Co(ii) complex

Single-molecule magnetism arising from cobalt(ii) nodes of a crystalline sponge

Slow relaxation of magnetization in a bis-mer-tridentate octahedral Co(ii) complex

The Computational Road to Better Catalysts

The Newman-Kwart rearrangement of O-aryl thiocarbamates: substantial reduction in reaction temperatures through palladium catalysis

Tunable Magnetization Dynamics through Solid-State Ligand Substitution Reaction.