D-Index & Metrics Best Publications
Chemistry
Spain
2023

D-Index & Metrics D-index (Discipline H-index) only includes papers and citation values for an examined discipline in contrast to General H-index which accounts for publications across all disciplines.

Discipline name D-index D-index (Discipline H-index) only includes papers and citation values for an examined discipline in contrast to General H-index which accounts for publications across all disciplines. Citations Publications World Ranking National Ranking
Chemistry D-index 85 Citations 34,888 1,373 World Ranking 1518 National Ranking 31

Research.com Recognitions

Awards & Achievements

2023 - Research.com Chemistry in Spain Leader Award

Overview

What is he best known for?

The fields of study he is best known for:

  • Organic chemistry
  • Molecule
  • Hydrogen

His main research concerns Crystallography, Computational chemistry, Hydrogen bond, Ab initio and Molecule. His work in Crystallography addresses issues such as Stereochemistry, which are connected to fields such as Medicinal chemistry and Ring. José Elguero has researched Computational chemistry in several fields, including Tautomer, Ab initio quantum chemistry methods, Atoms in molecules, Coupling constant and Chemical shift.

As part of one scientific family, José Elguero deals mainly with the area of Hydrogen bond, narrowing it down to issues related to the Intramolecular force, and often Resonance. His studies deal with areas such as Lone pair, Trimer, Interaction energy, Atom and Binding energy as well as Ab initio. His Molecule research includes themes of Protonation, Benzene, Proton and Density functional theory.

His most cited work include:

  • From weak to strong interactions: A comprehensive analysis of the topological and energetic properties of the electron density distribution involving X–H⋯F–Y systems (975 citations)
  • Behavior of Ylides Containing N, O, and C Atoms as Hydrogen Bond Acceptors (832 citations)
  • The Tautomerism of heterocycles (454 citations)

What are the main themes of his work throughout his whole career to date?

José Elguero spends much of his time researching Crystallography, Computational chemistry, Stereochemistry, Molecule and Hydrogen bond. His research investigates the link between Crystallography and topics such as Binding energy that cross with problems in Halogen. The concepts of his Computational chemistry study are interwoven with issues in Tautomer, Ab initio quantum chemistry methods, Protonation, Coupling constant and Chemical shift.

His biological study deals with issues like Medicinal chemistry, which deal with fields such as Organic chemistry. His Molecule study frequently involves adjacent topics like Crystal. His Hydrogen bond research is multidisciplinary, incorporating perspectives in Hydrogen, Intramolecular force, Proton and Photochemistry.

He most often published in these fields:

  • Crystallography (33.19%)
  • Computational chemistry (27.93%)
  • Stereochemistry (23.18%)

What were the highlights of his more recent work (between 2014-2021)?

  • Crystallography (33.19%)
  • Molecule (21.09%)
  • Binding energy (5.98%)

In recent papers he was focusing on the following fields of study:

His primary areas of study are Crystallography, Molecule, Binding energy, Computational chemistry and Hydrogen bond. His research in Crystallography intersects with topics in Halogen, Non-covalent interactions, Lewis acids and bases, Ab initio and Stereochemistry. His Molecule study combines topics from a wide range of disciplines, such as Solvent effects, Electron donor and Transition state.

His studies in Binding energy integrate themes in fields like Lone pair, Base, Covalent bond, Intermolecular force and Coupling constant. His Computational chemistry study combines topics in areas such as Protonation, Electron, Tautomer and Chemical shift. His Hydrogen bond research integrates issues from Hydrogen, Natural bond orbital and Intramolecular force.

Between 2014 and 2021, his most popular works were:

  • Not Only Hydrogen Bonds: Other Noncovalent Interactions (77 citations)
  • Cooperativity in Tetrel Bonds (71 citations)
  • Pnicogen and hydrogen bonds: Complexes between PH3X+ and PH2X systems (59 citations)

In his most recent research, the most cited papers focused on:

  • Organic chemistry
  • Molecule
  • Hydrogen

José Elguero mostly deals with Crystallography, Binding energy, Ab initio, Hydrogen bond and Computational chemistry. His study in Crystallography is interdisciplinary in nature, drawing from both Molecule, Lone pair, Halogen, Covalent bond and Stereochemistry. His work in the fields of Stereochemistry, such as Substituent, intersects with other areas such as Gene isoform.

His work carried out in the field of Ab initio brings together such families of science as Hydrogen, Singlet state, Group and Coupling constant. The various areas that José Elguero examines in his Hydrogen bond study include Electrostatics, Solvent effects, Chalcogen and Imidazole. His Computational chemistry research includes elements of Chemical shift and Electron, Electron density, Atoms in molecules.

This overview was generated by a machine learning system which analysed the scientist’s body of work. If you have any feedback, you can contact us here.

Best Publications

From weak to strong interactions: A comprehensive analysis of the topological and energetic properties of the electron density distribution involving X–H⋯F–Y systems

Enrique Espinosa;Ibon Alkorta;José Elguero;Elies Molins.
Journal of Chemical Physics (2002)

1864 Citations

Behavior of Ylides Containing N, O, and C Atoms as Hydrogen Bond Acceptors

Isabel Rozas;and Ibon Alkorta;José Elguero.
Journal of the American Chemical Society (2000)

1248 Citations

The Tautomerism of heterocycles

José Elguero.
(1976)

701 Citations

Interaction of Anions with Perfluoro Aromatic Compounds

Ibon Alkorta;Isabel Rozas;José Elguero.
Journal of the American Chemical Society (2002)

512 Citations

About the evaluation of the local kinetic, potential and total energy densities in closed-shell interactions

E. Espinosa;I. Alkorta;I. Rozas;J. Elguero.
Chemical Physics Letters (2001)

448 Citations

Basicity and Acidity of Azoles

Javier Catalan;Jose Elguero.
Advances in Heterocyclic Chemistry (1987)

294 Citations

Water Clusters: Towards an Understanding Based on First Principles of Their Static and Dynamic Properties

Jesus M. Ugalde;Ibon Alkorta;José Elguero.
Angewandte Chemie (2000)

271 Citations

Cooperativity in multiple unusual weak bonds

Ibon Alkorta;Fernando Blanco;Pere M. Deyà;José Elguero.
Theoretical Chemistry Accounts (2010)

267 Citations

Carbon-13 Magnetic Resonance Studies of Azoles. Tautomerism, Shift Reagent Effects, and Solvent Effects

Jose Elguero;Claude Marzin;John D. Roberts.
Journal of Organic Chemistry (1974)

256 Citations

N‐polyazolylmethanes. 1. Synthesis and nmr study of N,N′‐diazolylmethanes

Sebastian Juliá;Pilar Sala;José Del Mazo;Manuel Sancho.
Journal of Heterocyclic Chemistry (1982)

239 Citations

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