Topological studies on heteroconjugated molecules |
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Authors: | Ivan Gutman |
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Affiliation: | (1) Department of Chemistry, Faculty of Sciences, University of Kragujevac, P.O. Box60, 34000 Kragujevac, Yugoslavia |
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Abstract: | A graph-theoretical analysis of certain -electron properties of alternant molecules with one heteroatom is given. Topological formulas for total -electron energy, -electron charge density, bond order and various polarizabilities are derived. The main results of the paper are summarized in Rules 1-7. |
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Keywords: | Graph theory Heteroconjugated molecules |
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