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Updated: Jun 9, 2025

Isotopic Effect in Double Proton Transfer Process of Porphycene Investigated by Enhanced QM/MM Method
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结对π耗尽和π-π堆叠相互作用的影响

Usman Ahmed1, Dage Sundholm1, Mikael P Johansson1,2

  • 1Department of Chemistry, Faculty of Science, University of Helsinki, A.I. Virtasen aukio 1, P.O. Box 55, FI-00014, Finland. Usman.Ahmed@helsinki.fi.

Physical chemistry chemical physics : PCCP
|October 24, 2024
PubMed
概括

键通过耗尽π电子来加强芳香环之间的π-π堆叠相互作用. 这项研究使用了先进的计算方法来分析这些非共价相互作用,揭示了分子自我组装的关键见解.

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