Rotation around (Y)Csp2 X bonds (XC, O; YCsp2 , O) within the framework of the molecular mechanics method

Khadiullin R.; Arshinova R.; Plyamovatyi A.

Rotation around (Y)Csp2 X bonds (XC, O; YCsp2 , O) within the framework of the molecular mechanics method

Plyamovatyi A.; Khadiullin R.; Arshinova R.

URI: https://dspace.kpfu.ru/xmlui/handle/net/132223

Date: 1990

Abstract:

Internal rotation around (Y)Csp2- X (X=;C, O; Y=;Csp2 , O) bonds is considered. A calculation scheme, taking into account heteroatom lone pair interactions, is used. Wide literature information, concerning the rotation discussed here, is gathered and analysed. Rotation barrier uniform values are proposed on the basis of original simulations and their nature is discussed. © 1990.

Show full item record

Files in this item

Name: SCOPUS00222860-19 ...

Size: 58.11Kb

Format: PDF

View/Open

This item appears in the following Collection(s)

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