Possible dimers of hypochlorous acid (HOCl) arising from hydrogen- and halogen-bond interactions

Computational and Theoretical Chemistry

Volumn 999, Issue , 2012, Pages 48-54

  Zhang, Zhifei ^a   Shen, Jian ^a   Jin, Nengzhi ^b   Chen, Liuping ^c   Yang, Zhaoyong ^d  

^a HEBEI UNITED UNIVERSITY   (China)

^b Super Computing Center of Gansu Province   (China)

^c SUN YAT SEN UNIVERSITY   (China)

^d INSTITUTE OF MEDICINAL BIOTECHNOLOGY   (China)

Author keywords

Atoms in molecules; Halogen bond; Hydrogen bond; Hypochlorous acid; Natural bond orbital

Indexed keywords

EID: 84869089155     PISSN: 2210271X     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.comptc.2012.08.013     Document Type: Article

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