THE INTERNAL ROTATION IN 1,1,1- TRIFLUORINEALKANES
Copyright policy )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 compounds. A comparison of the rotation characteristics of studied molecules those of same in n-alkanes and 1-monofluorine alkanes was performed. The transferability of rotation parameters around C — C bonds has been showed.
- Tver State University Russian Federation
- Tver State Medical University Russian Federation
potential function, internal rotation, 1, 1-trifluorine alkanes, Physical and theoretical chemistry, QD450-801, conformational analysis
potential function, internal rotation, 1, 1-trifluorine alkanes, Physical and theoretical chemistry, QD450-801, conformational analysis
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