The borderless world of chemical bonding across the van der Waals crust and the valence region

Echeverría, Jorge (Universidad de Zaragoza) ; Álvarez, Santiago

Resumen: The definition of the van der Waals crust as the spherical section between the atomic radius and the van der Waals radius of an element is discussed and a survey of the application of the penetration index between two interacting atoms in a wide variety of covalent, polar, coordinative or noncovalent bonding situations is presented. It is shown that this newly defined parameter permits the comparison of bonding between pairs of atoms in structural and computational studies independently of the atom sizes.

Idioma: Inglés

DOI: 10.1039/d3sc02238b

Año: 2023

Publicado en: CHEMICAL SCIENCE 42 (2023), 11647-11688
ISSN: 2041-6520

Factor impacto JCR: 7.6 (2023)

Categ. JCR: CHEMISTRY, MULTIDISCIPLINARY rank: 40 / 231 = 0.173 (2023) - Q1 - T1

Factor impacto CITESCORE: 14.4 - Chemistry (all) (Q1)

Factor impacto SCIMAGO: 2.333 - Chemistry (miscellaneous) (Q1)

Financiación: info:eu-repo/grantAgreement/ES/AEI/MDM-2017-0767
Financiación: info:eu-repo/grantAgreement/ES/DGA/E07-23R
Financiación: info:eu-repo/grantAgreement/ES/MCINN/PID2019-109119GA-I00
Financiación: info:eu-repo/grantAgreement/ES/MICINN/RYC-2017-22853
Financiación: info:eu-repo/grantAgreement/ES/MICIU/PGC2018-093863-B-C21

Tipo y forma: Article (Published version)

Área (Departamento): Área Química Inorgánica (Dpto. Química Inorgánica)