Disrotatory and conrotatory transition structures for the Fe(CO)3-templated rearrangement of methylenecyclopropane to trimethylenemethane

被引:19
作者
Tantillo, DJ [1 ]
Carpenter, BK [1 ]
Hoffmann, R [1 ]
机构
[1] Cornell Univ, Dept Chem & Biol Chem, Ithaca, NY 14853 USA
关键词
D O I
10.1021/om010579p
中图分类号
O61 [无机化学];
学科分类号
070301 ; 081704 ;
摘要
Hybrid HF-DFT calculations were used to compute the structures and relative energetics of competing disrotatory and conrotatory transition states for ring-opening of Fe(CO)(3)-complexed methylenecyclopropanes.
引用
收藏
页码:4562 / 4564
页数:3
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