Geometrical changes during the internal rotation in ethane

被引:14
作者
Monkhorst, H. J. [1 ]
机构
[1] Univ Groningen, Dept Struct Chem, Groningen, Netherlands
关键词
D O I
10.1016/0009-2614(69)80232-0
中图分类号
O64 [物理化学(理论化学)、化学物理学];
学科分类号
070304 ; 081704 ;
摘要
Theoretical and experimental indications are presented that the predominant geometrical change during the internal rotation in ethane is a stretching of the CC bond by about 1%. going from the staggered to the eclipsed conformation. This suggests that the rotation barrier is primarily caused by the non-cylindrical symmetry of the central bond, and, to a less extent, by the nature of the hydrogen atoms.
引用
收藏
页码:289 / 291
页数:3
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