Chemical pressure–chemical knowledge: squeezing bonds and lone pairs within the valence shell electron pair repulsion model-Reference-Cited by-同舟云学术

Chemical pressure–chemical knowledge: squeezing bonds and lone pairs within the valence shell electron pair repulsion model

Published:2019 Issue:23 Volume:21 Page:12585-12596
ISSN:1463-9076
Container-title:Physical Chemistry Chemical Physics
language:en
Short-container-title:Phys. Chem. Chem. Phys.

Author:

Lobato A.¹²³⁴⁵^ORCID,Osman H. H.¹⁶⁷⁸⁹,Salvadó M. A.¹⁶⁷⁸⁹^ORCID,Taravillo M.¹²³⁴⁵^ORCID,Baonza V. G.¹²³⁴⁵^ORCID,Recio J. M.¹⁶⁷⁸⁹^ORCID

Affiliation:

1. Malta-Consolider Team

2. Dpto. de Química Física

3. Facultad de Ciencias Químicas

4. Universidad Complutense de Madrid

5. 28040 Madrid

6. Dpto de Química Física y Analítica

7. Universidad de Oviedo

8. E-33006 Oviedo

9. Spain

Abstract

Bond and lone pairs are identified by the Chemical Pressure formalism providing correlations between ligand electronegativity and molecular activity within the VSEPR-LCP model.

Funder

Universidad Complutense de Madrid

Ministerio de Educación, Cultura y Deporte

Ministerio de Ciencia e Innovación

Ministerio de Economía y Competitividad

Fundación para el Fomento en Asturias de la Investigación Científica Aplicada y la Tecnología

Publisher

Royal Society of Chemistry (RSC)

Subject

Physical and Theoretical Chemistry,General Physics and Astronomy

Link

http://pubs.rsc.org/en/content/articlepdf/2019/CP/C9CP00913B

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4. R. J. Gillespie , Molecular Geometry , Van Nostrand Reinhold , London , 1972

5. Investigation of the basis of the valence shell electron pair repulsion model by ab initio calculation of geometry variations in a series of tetrahedral and related molecules

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