Theory of asymmetric organocatalysis of aldol and related reactions: Rationalizations and predictions

被引:434
作者
Allemann, C [1 ]
Gordillo, R [1 ]
Clemente, FR [1 ]
Cheong, PHY [1 ]
Houk, KN [1 ]
机构
[1] Univ Calif Los Angeles, Dept Chem & Biochem, Los Angeles, CA 90095 USA
关键词
D O I
10.1021/ar0300524
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
Computational studies have led to models to understand some classic and contemporary asymmetric reactions involving organo-catalysts. The Hajos-Parrish-Eder-Sauer-Wiechert reaction and intermolecular aldol reactions as well as Mannich reactions and oxyaminations catalyzed by proline and other amino acids, and Diels-Alder reactions catalyzed by MacMillan's chiral amine organocatalysts have been studied with density functional theory. Quantitative predictions for several new catalysts and reactions are provided.
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页码:558 / 569
页数:12
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