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Updated: Jun 2, 2025

Isotopic Effect in Double Proton Transfer Process of Porphycene Investigated by Enhanced QM/MM Method
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π-π 相互作用に対する置換体およびヘテロアトムの影響:平行移動の π スタッキングが四極静電学によって引き起こされない証拠

Brandon Schramm1, Montgomery Gray1, John M Herbert1

  • 1Department of Chemistry and Biochemistry, The Ohio State University, Columbus, Ohio 43210, United States.

Journal of the American Chemical Society
|January 17, 2025
PubMed
まとめ

アロマティックリングは,四極の静電ではなく,分散と反発によって駆動される,対面の配置よりも平行移動の積み重ねを好みます. この発見は 超分子材料の設計に影響します

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