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- W181805580 abstract "The effects of electron-donating substituents on the bond alternations in pentalene have been evaluated by using the Pariser-Parr-Pople-type SCF MO CI method in conjunction with a variable bond-length technique [257]. A valence bond treatment of aromaticity, first introduced by Mulder and Oosterhoff, has now been applied to pentalene [258]. MNDO, UMDDO, and MNDO/CI calculations have also been reported for pentalene [259].KeywordsMaleic AnhydrideTheoretical InterestDimethyl AcetylenedicarboxylateBond AlternationVersus MoleculeThese keywords were added by machine and not by the authors. This process is experimental and the keywords may be updated as the learning algorithm improves." @default.
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- W181805580 date "1987-01-01" @default.
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- W181805580 title "Molecules of Theoretical Interest" @default.
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