AN EVALUATION OF THE ROTATIONAL BARRIER ABOUT THE B-N BOND OF 1-AMINOBOREPINS

被引:9
作者
ASHE, AJ
KLEIN, W
ROUSSEAU, R
机构
[1] Department of Chemistry, The University of Michigan, Ann Arbor
关键词
BORON; NITROGEN; AMINOBORANE; BOREPIN; AM1; CALCULATIONS; NUCLEAR MAGNETIC RESONANCE;
D O I
10.1016/0022-328X(94)80025-1
中图分类号
O61 [无机化学];
学科分类号
070301 ; 081704 ;
摘要
C-13 NMR spectroscopy has been used to determined the barriers to rotation about the B-N bonds of 1-(N-benzyl-N-methylamino)borepin and 1-(N-benzyl-N-methylamino)-4,5-dihydroborepin as 18 and 19.8 kcal mol-1, respectively. The corresponding rotational barriers of a variety of aminoboranes have been calculated using the semi-empirical AM1 method.
引用
收藏
页码:21 / 23
页数:3
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