MO Studies of Configurations and Conformations (). Composite Structure Analysis of Nonbonded Interactions

摘要

Composite ￥e-structure analysis has been proposed for predicting relative isomer stabilities based on nonbonded effects: all the possible crowded ￥e-structures are identified for each isomer, and the systems are represented by abbreviated notation of (n￥e/m) : then using simple rules and additivity of the nonbonded effects, the order of stability can be determined. A number of examples are given in support of this analytical procedure.