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Updated: Jul 17, 2026

Isotopic Effect in Double Proton Transfer Process of Porphycene Investigated by Enhanced QM/MM Method
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ポルフィセンの二重水素トンネルの振動ゲーティング

Michał Gil1, Jacek Waluk

  • 1Institute of Physical Chemistry, Polish Academy of Sciences, Kasprzaka 44/52, 01-224 Warsaw, Poland.

Journal of the American Chemical Society
|February 1, 2007
PubMed
まとめ

この研究では,ポルフィセンのタウトメリゼーションには,熱によって活性化される同期の二重水素トンネルが含まれていることが明らかになりました. 振動はダイナミックに水素結合を変化させ,反応経路に影響を与え,ポルフィリンメカニズムとは異なる.

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