๐”– Bobbio Scriptorium
โœฆ   LIBER   โœฆ

Ab initio studies on proton transfer involving Schiff base and related nitrogen compounds

โœ Scribed by N. Sreerama; Saraswathi Vishveshwara

Book ID
107803141
Publisher
Elsevier Science
Year
1989
Tongue
English
Weight
469 KB
Volume
212
Category
Article
ISSN
0022-2860

No coin nor oath required. For personal study only.

๐Ÿ“œ SIMILAR VOLUMES

A comparative AM1 and ab initio study of
A comparative AM1 and ab initio study of the intramolecular proton transfer in tautomeric organic compounds
โœ Uko Maran; Mati Karelson; Alan R. Katritzky ๐Ÿ“‚ Article ๐Ÿ“… 1996 ๐Ÿ› John Wiley and Sons ๐ŸŒ English โš– 513 KB

The proton-transfer barriers along the intramolecular hydrogen bond in a series of substituted salicylaldehyde anils were calculated using the AM1 SCF semiempirical method. The reliability of this method for the calculation of proton-transfer barriers was analyzed by the comparison of AM1 barriers f