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Determination of Unconjugated Carbon Sites in Benzenoid Derivatives
Authors:Tetsuo Morikawa  Ivan Gutman
Affiliation:1. Chemistry Department , Joetsu University of Education , Joetsu , 943-8512 , Japan;2. Faculty of Science , University of Kragujevac , P.O. Box 60, YU-34000 , Kragujevac , Yugoslavia
Abstract:Rules 1–4 for judging whether or not a given hydrocarbon benzenoid derivative is topologically stable, are proved. Here each conjugated derivative is expressed as a hexagon-shaped molecular (hydrogen-suppressed) graph, and has unconjugated carbon sites such as methylene, carbonyl, and radical groups, in its boundary.
Keywords:Unconjugated carbon site  Hydrocarbon benzenoid derivative  Topological stability  Kekulé structure count  Essential single bond
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