The internal rotation in 1,1,1-trifluorinealkanes

14 potential functions V(φ) of the internal rotations around the C — C bonds in molecules of 1,1,1-trifluorine alkanes CF3 — (CH2)n — CH3, where 1 ≤ n ≤ 4, were obtained and approximated by Fourier series. The local minima of V(φ) and transition states (TS) have been studied for all examined compoun...

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Bibliographic Details
Main Authors: A.V. Kotomkin, N.P. Rusakova, V.V. Turovtsev, Yu.D. Orlov
Format: Article
Language:Russian
Published: Tver State University 2017-12-01
Series:Физико-химические аспекты изучения кластеров, наноструктур и наноматериалов
Subjects:
1
Online Access:http://physchemaspects.ru/archives/2017/fh2017-doi-10-26456-pcascnn-2017-9-258.pdf