MNDO Study of Nitrogen Atom Inversion in Piperazine, N,N'-Dimethylpiperazine and N,N'-Dichloropiperazine

MNDO Study of Nitrogen Atom Inversion in Piperazine, N,N'-Dimethylpiperazine and N,N'-Dichloropiperazine

MNDO semi-empirical SCF MO calculations are used to study the pyramidal nitrogen atom inversion and configurational equilibria in the title compounds.

Bibliographic Details
Main Authors: Issa Yavari, Davood Bori Shargh, Hossein Fallah Bagher Shaidaii, Mohsen Dadgar
Format: Article
Language:English
Published: Iranian Institute of Research and Development in Chemical Industries (IRDCI)-ACECR 1997-12-01
Series:Iranian Journal of Chemistry & Chemical Engineering
Subjects:
mndo calculations
nitrogen inversion
stereochemistry
conformational analysis
Online Access:http://www.ijcce.ac.ir/article_10124_e7b38aa1f08787570e1ee66881933357.pdf

Internet

http://www.ijcce.ac.ir/article_10124_e7b38aa1f08787570e1ee66881933357.pdf

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