✦ LIBER ✦

Ab Initio Study of the Diels-Alder Reaction between Phospholes and Ethyne

✍ Scribed by Bachrach, Steven M.

Book ID: 126823283
Publisher: American Chemical Society
Year: 1994
Tongue: English
Weight: 851 KB
Volume: 59
Category: Article
ISSN: 0022-3263
DOI: 10.1021/jo00096a055

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Ab initio investigation of the diels-ald

Ab initio investigation of the diels-alder reaction between 2H-phosphole and phosphaethene: A model for phosphole dimerization

✍ Salzner, Ulrike; Bachrach, Steven M.; Mulhearn, Debbie C. 📂 Article 📅 1997 🏛 John Wiley and Sons 🌐 English ⚖ 415 KB 👁 2 views

All four possible Diels᎐Alder reactions between 2 H-phosphole and phosphaethene were examined at various theoretical levels, including HF, Ž . MP4SDQ, CCSD T , and CASSCF. MP2r6-31G\* geometry optimizations could not be employed since the potential energy surface is qualitatively incorrect at this l

Ab Initio Studies of the Radical Cation

Ab Initio Studies of the Radical Cation Diels−Alder Reaction

✍ Haberl, Udo; Wiest, Olaf; Steckhan, Eberhard 📂 Article 📅 1999 🏛 American Chemical Society 🌐 English ⚖ 104 KB

Diels-Alder Reaction of Furan with Cyclo

Diels-Alder Reaction of Furan with Cyclopropenone. An ab Initio Study

✍ Bachrach, Steven M. 📂 Article 📅 1995 🏛 American Chemical Society 🌐 English ⚖ 521 KB

An ab Initio Study of Facial Selectivity

An ab Initio Study of Facial Selectivity in the Diels−Alder Reaction

✍ Xidos, James D.; Poirier, Raymond A.; Pye, Cory C.; Burnell, D. Jean 📂 Article 📅 1998 🏛 American Chemical Society 🌐 English ⚖ 187 KB

An ab initio theoretical reaction path s

An ab initio theoretical reaction path study of the cation radical Diels-Alder reaction

✍ Bauld, Nathan L. 📂 Article 📅 1992 🏛 American Chemical Society 🌐 English ⚖ 595 KB

Diels−Alder Reaction of Phosphaethene wi

Diels−Alder Reaction of Phosphaethene with 1,3-Dienes: An ab Initio Study

✍ Wannere, Chaitanya S.; Bansal, Raj K.; Schleyer, Paul von Ragué 📂 Article 📅 2002 🏛 American Chemical Society 🌐 English ⚖ 400 KB