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- W2288129849 abstract "On the basis of the new atomic valence named δ(superscript z superscript i) , which is defined, and the adjacency matrix of molecular topological graph, a novel molecular connectivity index (superscript m)Z(superscript h) (m=0,1) is constructed. The correlations between 0Z(superscript h), 1Z(superscript h) and physical and chemical properties of alkyl benzenes, such as combustion heat, parachor, boiling point, heat of vaporization, standard free energy of formation, standard entropy, molar vo1,water soluhility, and partition coefficient of n-octanol/water, are investigated. The results show that 0Z(superscript h) and 1Z(superscript h) have good structure-property correlativity with physical and chemical properties of alkyl benzenes, and all the two variable correlation coefficients are larger than 0.99. For physical and chemical properties of alkyl benzenes, predicted results of the three variable linear regression equations with 0Z(superscript h), 1Z(superscript h) and N(subscript C) (the number of carbon atoms in molecule) as independent variable are quite satisfactory." @default.
- W2288129849 created "2016-06-24" @default.
- W2288129849 creator A5038501133 @default.
- W2288129849 date "2008-02-01" @default.
- W2288129849 modified "2023-09-23" @default.
- W2288129849 title "分子连接性指数((上标 m)Z(下标 h))与烷基苯理化性质的相关性研究" @default.
- W2288129849 hasPublicationYear "2008" @default.
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