Modelling of solvent effects on the Diels-Alder reaction

被引：105

作者：

Cativiela, C

Garcia, JI

Mayoral, JA

Salvatella, L

机构：

来源：

CHEMICAL SOCIETY REVIEWS | 1996年 / 25卷 / 03期

关键词：

D O I：

10.1039/cs9962500209

中图分类号：

O6 [化学];

学科分类号：

0703 ;

摘要：

This review presents a summary of the-different approaches used quantitatively to describe solvent effects on Diels-Alder reactions. Basically, two methodologies are considered: on the one hand, empirical models, based on solvent parameter scales and linear regression analyses, and on the other hand, theoretical models, based on quantum chemical and Monte Carlo calculations. It is shown that both approaches lead to similar conclusions, and provide complementary information on these processes.

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页码：209 / &

页数：11

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