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Updated: Jul 17, 2026

Exploring the Radical Nature of a Carbon Surface by Electron Paramagnetic Resonance and a Calibrated Gas Flow
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Ab initio 直動的ダイナミクス サイクロプロピル基のリング開き研究

David J Mann1, William L Hase

  • 1Department of Chemistry and Institute for Scientific Computing, Wayne State University, Detroit, MI 48202, USA.

Journal of the American Chemical Society
|March 28, 2002
PubMed
まとめ

サイクロプロピルラジカルリング開封の立体化学をシミュレートした. ディスロータリーが予測される一方で,コンロータリー経路が観察され,アルリル基の産物におけるエネルギー再分配が不完全であることを示した.

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