A study of hydrogen bonds in p-substituted calix[4]- and calix[6]arenes by ab initio and electron density functional methods

Journal of Structural Chemistry

Volumn 51, Issue 6, 2010, Pages 1024-1033

  Novikov, A N ^a   Shapiro, Yu E ^a  

^a ODESSA NATIONAL UNIVERSITY   (Ukraine)

Author keywords

electron density functional method; Grootenhuis et al. method; Hammett constants; Hartree Fock method; hydrogen bond; multiple correlation; p halogenocalix 4 arene; p halogenocalix 6 arene; p substituted calixarene

Indexed keywords

EID: 79952662184     PISSN: 00224766     EISSN: None     Source Type: Journal    
DOI: 10.1007/s10947-010-0159-z     Document Type: Article

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