EXPERIMENTAL FORMAL STERIC ENTHALPY .1. ALKANES AND CYCLOALKANES

被引：12

作者：

DETAR, DF

机构：

[1] Department of Chemistry, Florida State University, Tallahassee

来源：

JOURNAL OF ORGANIC CHEMISTRY | 1991年 / 56卷 / 04期

关键词：

D O I：

10.1021/jo00004a023

中图分类号：

O62 [有机化学];

学科分类号：

070303 ; 081704 ;

摘要：

This study makes a critical evaluation of experimental values of formal steric enthalpies derived from published values of enthalpies of formation of alkanes and cycloalkanes (gas phase, 298 K). These provide primary data for calibration of force fields used in molecular mechanics.

引用

页码：1463 / 1470

页数：8

共 23 条

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