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There may exist another concurrent reaction, the C-H insertion to form propene. We have located the transition state for it, and the structure of this transition state has been added to the Supporting Information. This transition state is similar to those reported by Bernardi et al, ref 10) and has a relatively high reaction barrier 27.0 kcal/mol at the B3LYP/6-311.G** level of theory, Considering that we are mainly concerned with the mechanisms that produce cyclopropanes for the lithium carbenoids, we didn't discuss it further in this paper
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There may exist another concurrent reaction, the C-H insertion to form propene. We have located the transition state for it, and the structure of this transition state has been added to the Supporting Information. This transition state is similar to those reported by Bernardi et al. (ref 10) and has a relatively high reaction barrier (27.0 kcal/mol at the B3LYP/6-311.G* * level of theory). Considering that we are mainly concerned with the mechanisms that produce cyclopropanes for the lithium carbenoids, we didn't discuss it further in this paper.
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