Theoretical study of the inclusion complexes of α and β-cyclodextrins with decyltrimethylammonium bromide (DTAB) and tetradecyltrimethylammonium bromide (TTAB)

Journal of Molecular Liquids

Volumn 135, Issue 1-3, 2007, Pages 153-157

  Rafati, A A ^a   Hashemianzadeh, S M ^b   Nojini, Z B ^a   Safarpour, M A ^b  

^a BU ALI SINA UNIVERSITY   (Iran)

^b IRAN UNIVERSITY OF SCIENCE AND TECHNOLOGY   (Iran)

Author keywords

Cyclodextrin; DFT; DTAB; HF; Inclusion complex; PM3; TTAB

Indexed keywords

COMPLEXATION; DENSITY FUNCTIONAL THEORY; ENTHALPY; STATISTICAL METHODS; VACUUM;

INCLUSION COMPLEX; NEGATIVE ENTHALPY; THERMODYNAMIC CALCULATIONS;

CYCLODEXTRINS;

EID: 34247570853     PISSN: 01677322     EISSN: None     Source Type: Journal    
DOI: 10.1016/j.molliq.2006.11.006     Document Type: Article

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