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- W2075247776 abstract "Recent studies of the π-electron properties of acenaphthylene, fluoranthene, and their congeners showed that the presence of phenyl–cyclopentadienyl (PCP) fragments amplifies the intensity of cyclic conjugation in the five-membered ring of the respective molecules. We now show that there exists a reasonably good correlation between two quantum mechanical measures of cyclic conjugation in the five-membered rings (the energy effect and the π-electron energy content) and the number of six-membered rings in PCP-constellations. We also offer a mathematical explanation of the PCP effect." @default.
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- W2075247776 date "2009-06-01" @default.
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- W2075247776 title "Quantitative study of the PCP effect" @default.
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- W2075247776 doi "https://doi.org/10.1016/j.cplett.2009.05.056" @default.
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