Dual one-centre frontier-orbital interactions in [2 + 2] cycloadditions of ketenes
- 1 January 1993
- journal article
- research article
- Published by Royal Society of Chemistry (RSC) in Journal of the Chemical Society, Chemical Communications
- No. 5,p. 450-452
- https://doi.org/10.1039/c39930000450
Abstract
Dual one-centre frontier–orbital interactions are found to control the paths of cycloadditions of ketene to ethylene, methylenimine and formaldehyde by the analysis of the intrinsic reaction coordinates calculated with the MP2/6-31G* basis set.Keywords
This publication has 0 references indexed in Scilit: