The nature of the C–Cl⋯Cl–C intermolecular interactions found in molecular crystals: a general theoretical-database study covering the 2.75–4.0 Å range

Abstract

An exhaustive study of the nature of the C–Cl⋯Cl–C interactions found in crystals has been carried out at the MP2/aug-cc-pVDZ level using model dimers and a set of 45 dimers with Cl⋯Cl distances in the 2.75–4 Å range.