AB-INITIO STUDIES OF THIOFORMOHYDROXAMIC ACID

Authors
SEKHON BS
Citation
Bs. Sekhon, AB-INITIO STUDIES OF THIOFORMOHYDROXAMIC ACID, Indian journal of chemistry. Sect. A: Inorganic, physical, theoretical & analytical, 33(3), 1994, pp. 237-238
Citations number
7
Categorie Soggetti
Chemistry
Journal title
Indian journal of chemistry. Sect. A: Inorganic, physical, theoretical & analytical → ACNP
ISSN journal
03764710
Volume
33
Issue
3
Year of publication
1994
Pages
237 - 238
Database
ISI
SICI code
0376-4710(1994)33:3<237:ASOTA>2.0.ZU;2-I
Abstract
Ab initio Hartree-Fock molecular orbital calculations for Z and E-keto forms of thioformohydroxamic acid (methanethioamide, N-hydroxy) were carried out using the 3-21 g basis sets. The optimized parameters of thioformohydroxamic acid are discussed in relation to formohydroxamic acid.