摘要
应用电荷自洽离散变分α近似计算方法，对Oppenauer氧化反应机理进行量子化学研究．计算结果表明：Oppenauer氧化反应发生环内氢负离子转移。
The reaction mechanism of the Oppenauer Oxidation is investigated by self-consistent Charge-discrete variation Xαcalculations. The results show that the Oppenauer Oxidation occurs by hydride ion transfer from the metal alkoxide to the carbonyl compound via a six-membered cyclic transition state.
出处
《集美大学学报（自然科学版）》
CAS
北大核心
1997年第2期26-29,共4页
Journal of Jimei University：Natural Science
