✦ LIBER ✦

Conformational Stability of Lactonitrile−Water Complexes: An ab Initio Study

✍ Scribed by Rivelino, Roberto; Canuto, Sylvio

Book ID: 125945038
Publisher: American Chemical Society
Year: 2004
Tongue: English
Weight: 114 KB
Volume: 108
Category: Article
ISSN: 1089-5639
DOI: 10.1021/jp037177a

No coin nor oath required. For personal study only.

📜 SIMILAR VOLUMES

Relative conformer stability of diphosph

Relative conformer stability of diphosphine and phosphinodifluorophosphine: An ab initio study

✍ K.D. Sen; K. Ohta; K. Morokuma 📂 Article 📅 1984 🏛 Elsevier Science 🌐 English ⚖ 360 KB

An ab initio study of vinylallene confor

An ab initio study of vinylallene conformations

✍ Bond, Douglas 📂 Article 📅 1990 🏛 American Chemical Society 🌐 English ⚖ 693 KB

Ab initio studies of peroxynitrite anion

Ab initio studies of peroxynitrite anion-water complexes

✍ Hui-Hsu Tsai; Tracy P. Hamilton; Jyh-Hsin M. Tsai; Joseph S. Beckman 📂 Article 📅 1995 🏛 Springer 🌐 English ⚖ 680 KB

An ab initio study of ammonia-hydrocarbo

An ab initio study of ammonia-hydrocarbon complexes

✍ A.-M. Sapse; Duli C. Jain 📂 Article 📅 1986 🏛 Elsevier Science 🌐 English ⚖ 429 KB

Conformational analysis of allylamine. A

Conformational analysis of allylamine. An ab initio molecular orbital study

✍ James Kao; Jeffrey I. Seeman 📂 Article 📅 1984 🏛 John Wiley and Sons 🌐 English ⚖ 575 KB

The conformational characteristics of allylamine were investigated by the ab initio STO-~G basis set. The results indicate that the molecule exists in a number of stable conformations through rotations about the CC-NH and CC-CN bonds. The TE ( &u~-CCNLP, LP representing lone-pair electrons, and ecli

An ab initio SCF study of conformational

An ab initio SCF study of conformational isomerism in HNO2

✍ Steen Skaarup; James E. Boggs 📂 Article 📅 1976 🏛 Elsevier Science 🌐 English ⚖ 623 KB