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Ab Initio Study of the Stability of the Ylide-like Intermediate Methyleneoxonium in the Reaction between Singlet Methylene and Water

✍ Scribed by Gonzalez, Carlos; Restrepo-Cossio, Albeiro; Márquez, Manuel; Wiberg, Kenneth B.

Book ID
121500090
Publisher
American Chemical Society
Year
1996
Tongue
English
Weight
133 KB
Volume
118
Category
Article
ISSN
0002-7863

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✍ Albeiro A. Restrepo-Cossio; Hermisul Cano; Frank Marí; Carlos A. Gonzalez 📂 Article 📅 1997 🏛 John Wiley and Sons 🌐 English ⚖ 313 KB 👁 2 views

In this study, we describe the results of ab initio (HF and MP2) and MNDO-PM3 calculations on the model reactions of unstabilized (Me 3 P‫ס‬CH-CH 3 ), semistabilized (Me 3 P‫ס‬CH-CϵCH), and stabilized (Me 3 P‫ס‬CH-CϵN) ylides with acetaldehyde to form their respective Z and E olefins and trimethylph