Contribution of localized molecular orbitals to the proton magnetic screening constant of PX3 molecules

dc.contributor.author	Aminova R.
dc.contributor.author	Zuev M.
dc.contributor.author	Morozova I.
dc.date.accessioned	2018-09-20T20:42:45Z
dc.date.available	2018-09-20T20:42:45Z
dc.date.issued	1979
dc.identifier.issn	0568-5230
dc.identifier.uri	https://dspace.kpfu.ru/xmlui/handle/net/146190
dc.description.abstract	1. A calculation of the magnetic screening constants of the protons in the PH3 and P(CH3)3 molecules with the aid of localized molecular orbitals has been carried out for the first time. 2. The contribution to σ from the canonical and localized molecular orbitals coincide with sufficient accuracy. 3. Localized molecular orbitals make it possible to individually evaluate the contribution of the bonds and lone pairs to the magnetic screening constant. © 1980 Plenum Publishing Corporation.
dc.relation.ispartofseries	Bulletin of the Academy of Sciences of the USSR Division of Chemical Science
dc.title	Contribution of localized molecular orbitals to the proton magnetic screening constant of PX3 molecules
dc.type	Article
dc.relation.ispartofseries-issue	10
dc.relation.ispartofseries-volume	28
dc.collection	Публикации сотрудников КФУ
dc.relation.startpage	2013
dc.source.id	SCOPUS05685230-1979-28-10-SID34250261115

Файлы в этом документе

Имя: SCOPUS05685230-19 ...

Размер: 44.12Kb

Формат: PDF

Публикации сотрудников КФУ Scopus [24551]
Коллекция содержит публикации сотрудников Казанского федерального (до 2010 года Казанского государственного) университета, проиндексированные в БД Scopus, начиная с 1970г.