Halogen bonding: Model complexes having dihalogen molecules bound to two nonequivalent electron-rich species.

NOVÁK, Martin, Cina FOROUTANNEJAD and Radek MAREK. Halogen bonding: Model complexes having dihalogen molecules bound to two nonequivalent electron-rich species. In VIIth workshop on modern methods in quantum chemistry. 2014.

Basic information

• Original name: Halogen bonding: Model complexes having dihalogen molecules bound to two nonequivalent electron-rich species.
• Name in Czech: Halogenové vazby: Modelové komplexy mající dihalogenové molekuly vázány dvěmi neekvivalentními skupinami bohatými na elektrony.
• Authors: NOVÁK, Martin, Cina FOROUTANNEJAD and Radek MAREK.
• Edition: VIIth workshop on modern methods in quantum chemistry, 2014.

Other information

• Original language: English
• Type of outcome: Presentations at conferences
• Field of Study: 10600 1.6 Biological sciences
• Confidentiality degree: is not subject to a state or trade secret
• Organization unit: Faculty of Science
• Keywords (in Czech): Halogenové vazby, DFT
• Keywords in English: Halogen bonding, DFT

Abstract

The nature of three-center halogen bonding of dihalogen molecules with substituted o-dimethoxybenzene was studied using quantum chemistry methods.