摘要
A novel atomic electronegative distance vector (AEDV) has been developed to express the chemical environment of various equivalent carbon in alcohols and four 4 parameter linear relationship between chemical shift and AEDV are created by using multiple linear regression.
A novel atomic electronegative distance vector (AEDV) has been developed to express the chemical environment of various equivalent carbon in alcohols and four 4 parameter linear relationship between chemical shift and AEDV are created by using multiple linear regression.
出处
《计算机与应用化学》
CAS
CSCD
2000年第1期188-188,共1页
Computers and Applied Chemistry
基金
国家教育部霍英东优秀青年教师基金
关键词
脂肪醇分子
碳环境结构表征
碳谱化学移位
Chemical Environment
Carbon
Atomic Clectronegative distance vector
