Abstract

Short atom-atom distances between molecules are almost always indicative of specific intermolecular bonding. These distances may be used to assess the significance of all hydrogen bonds, including the C-H⋯O and even weaker C-H⋯F varieties.

Highlights

  • Dunitz refers to the atoms in molecules (AIM) approach (Bader, 1990) and while there are opposite points of view, a beginning can be made if one states that when a bond critical point (BCP) is absent, there is no interaction

  • Most short contact distances in crystals arise from stabilizing interactions that originate from attraction

  • Any generalization that all short C–HÁ Á ÁC, C–HÁ Á ÁO, C–HÁ Á ÁF, C–HÁ Á ÁCl or C–ClÁ Á ÁCl interactions found in crystals are repulsive or destabilizing, or that they arise purely as a result of accompanying stronger interactions or vague close packing considerations is certainly not justified

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Summary

Introduction

Dunitz refers to the atoms in molecules (AIM) approach (Bader, 1990) and while there are opposite points of view, a beginning can be made if one states that when a bond critical point (BCP) is absent, there is no interaction. Most short contact distances in crystals arise from stabilizing interactions that originate from attraction.

Results
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