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Title: Correlation of line graph parameters with physicochemical properties of octane isomers
Authors: Kuanar, Minati
Kuanar, Saroj K
Mishra, Bijay K
Gutman, Ivan
Issue Date: Jun-1999
Publisher: NISCAIR-CSIR, India
Abstract: Line graphs and their derivatives are constructed for hydrogen-depleted structural graphs of octane isomers, and respective topological indices, θi, are derived. The parameters obtained from first to fourth derivatives of the line graphs are used in obtaining quantitative structure-property relationships using several physicochemical properties of 18 octane isomers. The regression analysis indicates that θ4 indices have the best discriminating ability for these compounds.
Page(s): 525-528
Appears in Collections:IJC-A Vol.38A(06) [June 1999]

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