C-13 NMR-SPECTRA OF POLYCYCLIC DIAZIRIDINES

被引：3

作者：

KAUPP, G ^{[1
]}

DENISENKO, SN ^{[1
]}

SHUSTOV, GV ^{[1
]}

KOSTYANOVSKII, RG ^{[1
]}

机构：

[1] UNIV OLDENBURG,W-2900 OLDENBURG,GERMANY

来源：

BULLETIN OF THE ACADEMY OF SCIENCES OF THE USSR DIVISION OF CHEMICAL SCIENCE | 1991年 / 40卷 / 11期

关键词：

D O I：

10.1007/BF00961031

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

A significant difference between experimental C-13 NMR chemical shifts and those predicted from the C-13 NMR/IR databank was found for bi- and tricyclic diaziridines. Quantum chemical (AM1) and molecular mechanical (MMX) calculations showed that the relative chemical shift of the nodal C atom is dependent mainly on deformations of the C-C-C valence angle at this atom.

引用

页码：2173 / 2176

页数：4

共 7 条

[1] C-13 NMR-SPECTRA OF BICYCLO[N.1.0]HYDROCARBONS [J].