Hexahalogenated and their mixed benzene derivatives as prototypes for the understanding of halogen···halogen intramolecular interactions: New insights from combined DFT, QTAIM-, and RDG-based NCI analyses.
Pradeep R. VaradwajArpita VaradwajBih-Yaw JinPublished in: J. Comput. Chem. (2015)