Article ID | Journal | Published Year | Pages | File Type |
---|---|---|---|---|
5382342 | Chemical Physics Letters | 2012 | 16 Pages |
Abstract
⺠Experimental observation of bridged iodoethyl radical. ⺠Trapping of key intermediate in prototypical electrophilic addition reaction of iodine and ethylene. ⺠Theory predicts bridged radical is global minimum on the C2H4I potential energy surface. ⺠MP2 provides a poor description of the potential energy surface due to spin-contamination effects.
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Authors
Lisa George, Aimable Kalume, Scott A. Reid,