A density functional study towards substituent effects on anion sensing with urea receptors

Substituent Effects on the Vinylcyclopro

Substituent Effects on the Vinylcyclopropane–Cyclopentene Rearrangement – A Theoretical Study by Restricted and Unrestricted Density Functional Theory

✍ Dirk Sperling; Jürgen Fabian 📂 Article 📅 1999 🏛 John Wiley and Sons 🌐 English ⚖ 172 KB 👁 2 views

The effect of donor substitution by the hydroxy group and of closely connected with the radical stabilizing properties of the substituents. As indicated by singlet/triplet splitting acceptor substitution by the cyano group on the activation energies of the vinylcyclopropane-cyclopentene rearrange-en