Dissection of the Factors Affecting Formation of a CH∙∙∙O H-Bond. A Case Study

Quantum calculations are used to examine how various constituent components of a large molecule contribute to the formation of an internal CH∙∙∙O H-bond. Such a bond is present in the interaction between two amide units, connected together by a series of functional groups. Each group is removed one...

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Bibliographic Details
Main Author: Steve Scheiner
Format: Article
Language:English
Published: MDPI AG 2015-08-01
Series:Crystals
Subjects:
Online Access:http://www.mdpi.com/2073-4352/5/3/327