首页> 外文期刊>Journal of Chemical Information and Computer Sciences >SIMILARITY APPROACH TO CHEMICAL REACTIVITY - OVERLAP DETERMINANT METHOD IN THE CHEMISTRY OF COMPLEX REACTIONS WITH COARCTATE TRANSITION STATES
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SIMILARITY APPROACH TO CHEMICAL REACTIVITY - OVERLAP DETERMINANT METHOD IN THE CHEMISTRY OF COMPLEX REACTIONS WITH COARCTATE TRANSITION STATES

机译:具有过渡态的复杂反应化学反应的化学反应性的相似确定-重叠法。

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摘要

The overlap determinant method was applied to the study of various carbene reactions for which the name ''complex'' reactions was recently proposed. It has been shown that the method is able to deal correctly with these reactions even in situations where the existing classical technique of correlation diagrams fails. In addition to correctly predicting the allowedness and/or forbiddenness of these reactions, the complementary similarity approach provides a simple insight into the detailed mechanism of these processes. [References: 17]
机译:重叠决定子方法被用于各种卡宾反应的研究,最近提出了“卡宾”反应。已经表明,即使在现有经典的相关图技术失败的情况下,该方法也能够正确处理这些反应。除了正确预测这些反应的允许和/或禁止之外,互补相似性方法还提供了对这些过程详细机制的简单了解。 [参考:17]

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