ON THE ORIGIN OF PI-FACIAL DIASTEREOSELECTIVITY IN NUCLEOPHILIC ADDITIONS TO CHIRAL CARBONYL-COMPOUNDS .3. ROTATIONAL PROFILES OF 2-METHOXYPROPANAL AND 2-N,N-DIMETHYLAMINOPROPANAL

被引:23
作者
FRENKING, G [1 ]
KOHLER, KF [1 ]
REETZ, MT [1 ]
机构
[1] MAX PLANCK INST COAL RES,W-4330 MULHEIM,GERMANY
关键词
D O I
10.1016/S0040-4020(01)89911-7
中图分类号
O62 [有机化学];
学科分类号
070303 ; 081704 ;
摘要
The rotational profiles of 2-methoxypropanal and 2-N,N-dimethylaminopropanal are theoretically predicted using ab initio methods at the MP2/6-31G*//3-21G level of theory. The conformational energies show a strong dependence on the torsion angle not only around the C-C bond but also around the C-R (R=OMe, NMe2) bond.
引用
收藏
页码:3971 / 3982
页数:12
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