Electronic Structure of Homological Series of Primary Amines and Aminyl Radicals

期刊论文
发表日期：

2024年12月1日

查看全文

E. M. Chernova,
M. Y. Orlov,
N. P. Rusakova,
Yu. D. Orlov

摘要

Abstract

The electronic structure of the molecules of monoalkylamines R–NH₂ and the corresponding radicals R–N^●H has been studied in the framework of the quantum theory of atoms in molecules. The values of charges and volumes of atomic groups are presented. The effect of functional groups containing O-, N-, S-atoms on the hydrocarbon chain is compared.