ChemInform Abstract: Molecular Model Studies Based on ab initio Calculations of Nucleophilic and Electrophilic Addition—Substitution Reactions Focused on Carbon—Halogen Compounds

Molecular model studies based on ab init

Molecular model studies based on ab initio calculations of nucleophilic and electrophilic addition-substitution reactions focused on carbon–halogen compounds

✍ Henk M. Buck 📂 Article 📅 2011 🏛 John Wiley and Sons 🌐 English ⚖ 173 KB

## Abstract We describe with molecular model studies based on the intrinsic parameters of van't Hoff's regular tetrahedron nucleophilic and electrophilic addition‐substitution reactions via a selected reaction coordinate for the displacement of carbon. Geometries of stable, intermediate transition