STRUCTURE-ACTIVITY-RELATIONSHIPS OF PHENETHYLAMINE - COMPARISON OF QUANTUM-MECHANICAL SCF AB-INITIO AND SEMIEMPIRICAL CALCULATIONS

被引：53

作者：

MARTIN, M

CARBO, R

PETRONGOLO, C

TOMASI, J

机构：

[1] CNR,LAB CHIM QUANTISTICA & ENERGETICA MOLEC,56100 PISA,ITALY

[2] INST QUIM SARRIA BARCELONA,DEPT QUIM ORG,SECCION QUIM CUANTICA,BARCELONA 17,SPAIN

来源：

JOURNAL OF THE AMERICAN CHEMICAL SOCIETY | 1975年 / 97卷 / 06期

关键词：

D O I：

10.1021/ja00839a009

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

引用

页码：1338 / 1347

页数：10

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