Isotope Effects in the Reaction of Benzo[h]quinoline N-Oxides with Methylsulfinyl Carbanion Examined by ab Initio Molecular Orbital Methods
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概要
- 論文の詳細を見る
The reactions of benzo[h]quinoline N-oxide with methylsulfinyl carbanion and deuterated methylsulfinyl carbanion, respectively, were studied theoretically. Differences in yield between these reactions were explained using ab initio molecular orbital methods by considering the zero-point energy correction and the barrier penetration effect. In these reactions, two transition states affected the total reaction rate. The hydrogen- or deuterium-transfer step played a significant role, accounting for the difference in reaction rates.
- 公益社団法人日本薬学会の論文
- 2005-05-01
著者
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Saito Koichi
Department Of Analytical Chemistry Faculty Of Pharmaceutical Sciences Hoshi University
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Takeuchi Isao
Faculty Of Pharmacy Meijo University
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MATSUZAKI Hisao
Tohoku Pharmaceutical University
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Kobayashi Akemi
Tohoku Pharmaceutical University
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Matsuzaki H
Tohoku Pharmaceutical University
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Saito Koichi
Department Of Agricultural Chemistry Faculty Of Agriculture Kyoto Prefectural University
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