ENERGETICS OF INTERMEDIATES AND REACTION STEPS INVOLVED IN THE HYDROFORMYLATION REACTION CATALYZED BY HCO(CO)4 - A THEORETICAL-STUDY BASED ON DENSITY FUNCTIONAL THEORY

被引:71
作者
VERSLUIS, L
ZIEGLER, T
BAERENDS, EJ
RAVENEK, W
机构
[1] UNIV CALGARY,DEPT CHEM,CALGARY T2N 1N4,ALBERTA,CANADA
[2] FREE UNIV AMSTERDAM,DEPT THEORET CHEM,1007 MC AMSTERDAM,NETHERLANDS
关键词
D O I
10.1021/ja00188a011
中图分类号
O6 [化学];
学科分类号
0703 ;
摘要
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页码:2018 / 2025
页数:8
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