화학공학소재연구정보센터
Thermochimica Acta, Vol.512, No.1-2, 273-277, 2011
Quantitative structure property relationship for Henry's law constant of some alkane isomers
A novel topological parameter has been derived by a bond disconnection protocol on a vertex weighted molecular graph. The parameter was correlated with other topological indices and has been applied successfully in quantitative structure property relationship (QSPR) for Henry's law constant of alkane isomers by using single and multiparametric equations separately. (C) 2010 Elsevier B.V. All rights reserved.