A B3LYP and MP2 theoretical investigation on unusual cation-π interaction between the singlet state HB{double bond, long}BH (1Δg) and H+, Li+, Na+, Be2+ or Mg2+

Journal of Molecular Structure: THEOCHEM

Volumn 909, Issue 1-3, 2009, Pages 79-85

  Wu, Yao jin ^a   Ren, Fu de ^a   Li, Bao cheng ^a  

^a NORTH UNIVERSITY OF CHINA   (China)

Author keywords

B double bond, long B double bond; Cation interaction; Electron density shifts

Indexed keywords

EID: 67650713555     PISSN: 01661280     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.theochem.2009.05.029     Document Type: Article

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