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Algebraic Kekulé structures of benzenoid hydrocarbons
Ivan Gutman1, Damir Vukicević, Ante Graovac
1Faculty of Science, University of Kragujevac, P.O. Box 60, 34000 Kragujevac, Serbia and Montenegro.
Abstract:
An algebraic Kekulé structure of a benzenoid hydrocarbon is obtained from an ordinary Kekulé structure by inscribing into each hexagon the number of pi-electrons which (according to this Kekulé structure) belong to this hexagon. We show that in the case of catafusenes, there is a one-to-one correspondence between ordinary and algebraic Kekulé structures. On the other hand, in the case of perifusenes, one algebraic Kekulé structure may correspond to several ordinary Kekulé structures.
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