Cargando…

Steric effects vs. electron delocalization: a new look into the stability of diastereomers, conformers and constitutional isomers

A quantum chemical investigation of the stability of compounds with identical formulas was carried out on 23 classes of compounds made of C, N, P, O and S atoms as core structures and halogens H, F, Cl, Br and I as substituents. All possible structures were generated and investigated by quantum mech...

Descripción completa

Detalles Bibliográficos
Autores principales: Datta, Sopanant, Limpanuparb, Taweetham
Formato: Online Artículo Texto
Lenguaje:English
Publicado: The Royal Society of Chemistry 2021
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9033979/
https://www.ncbi.nlm.nih.gov/pubmed/35479364
http://dx.doi.org/10.1039/d1ra02877d