MINDO/3 (and in some cases MNDO) calculations on substituted Z-propentdyopents, their anions and cations, and some propentdyopent adducts are reported. Using the frontier orbital model, predictions of reactivity are made for the various systems, and are related to known experimental results.
R. Bonnett and M. A. Vallés, J. Chem. Soc., Perkin Trans. 2, 1987, 1893 DOI: 10.1039/P29870001893
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