| Article ID | Journal | Published Year | Pages | File Type |
|---|---|---|---|---|
| 1403785 | Journal of Molecular Structure | 2011 | 8 Pages |
Abstract
⺠N-(1,1-Dioxo-1,2-benzisothiazol-3-yl)-amine-1H-tetrazole (BAT) is a multidentate ligand. ⺠Conformational and tautomeric preferences of BAT were investigated in the crystal and isolated in argon matrix. ⺠Vibrational spectra assigned, for crystalline sample and for matrix-isolated compound. ⺠The crystal contains the tautomer enabling more favourable intermolecular interactions. ⺠In the argon matrix, the most stable tautomer predicted by calculations is formed. A conversion mechanism is proposed.
Keywords
Related Topics
Physical Sciences and Engineering
Chemistry
Organic Chemistry
Authors
A. Gómez-Zavaglia, A. Ismael, L.I.L. Cabral, A. Kaczor, J.A. Paixão, R. Fausto, M.L.S. Cristiano,