Cargando…
A focus on penetration index – a new descriptor of chemical bonding
Electron clouds surrounding atoms interpenetrate in a molecule, due to weak van der Waals interactions or formation of a genuine chemical bond. Now, Alvarez and Echeverría (S. Alvarez, J. Echeverría, Chem. Sci., 2023, https://doi.org/10.1039/D3SC02238B) suggest a simple descriptor of how deep this i...
Autor principal: | Grochala, Wojciech |
---|---|
Formato: | Online Artículo Texto |
Lenguaje: | English |
Publicado: |
The Royal Society of Chemistry
2023
|
Materias: | |
Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC10619538/ https://www.ncbi.nlm.nih.gov/pubmed/37920354 http://dx.doi.org/10.1039/d3sc90191b |
Ejemplares similares
-
III-defined concepts in chemistry: rigid force constants vs. compliance constants as bond strength descriptors for the triple bond in diboryne
por: Grunenberg, Jörg
Publicado: (2015) -
Learning continuous and data-driven molecular descriptors by translating equivalent chemical representations
por: Winter, Robin, et al.
Publicado: (2018) -
Quadripartite bond length rule applied to two prototypical aromatic and antiaromatic molecules
por: Wolański, Łukasz, et al.
Publicado: (2023) -
Theoretical study of ternary silver fluorides AgMF(4) (M = Cu, Ni, Co) formation at pressures up to 20 GPa
por: Domański, Mateusz A., et al.
Publicado: (2021) -
Fundamental Aspects of Skin Cancer Drugs via Degree-Based Chemical Bonding Topological Descriptors
por: Khan, Abdul Rauf, et al.
Publicado: (2023)