Comment on "Evaluation of Y- versus linear-delocalization and the role of charge alternation in trimethylenemethane dianion and butadiene dianions"

Gernot Frenking, Alberto Gobbi

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7 引用 (Scopus)

摘要

The conclusions on the relative stabilities of linear and Y-conjugated forms of the C4H2-6 dianion by Agranat, Radhakrishnan, Herndon, and Skancke are based on calculated structures which are higher-order saddle points and not minima on the potential energy hypersurface. The energy minimum conformations clearly show that the trimethylenemethane dianion is more stable than the linear forms because of a more favorable charge distribution.

源语言英语
页(从-至)335-337
页数3
期刊Chemical Physics Letters
197
3
DOI
出版状态已出版 - 11 9月 1992
已对外发布

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