FAR-INFRARED OF THE LOCAL-ANESTHETIC PROCAINE

Authors
Citation
Ma. Palafox, FAR-INFRARED OF THE LOCAL-ANESTHETIC PROCAINE, Spectroscopy letters, 30(8), 1997, pp. 1495-1514
Citations number
29
Categorie Soggetti
Spectroscopy
Journal title
ISSN journal
00387010
Volume
30
Issue
8
Year of publication
1997
Pages
1495 - 1514
Database
ISI
SICI code
0038-7010(1997)30:8<1495:FOTLP>2.0.ZU;2-I
Abstract
The low spectral region of procaine was studied by far-infrared spectr oscopy. Raman lines were registered and interpreted. An equivalent stu dy was performed on the molecule of benzocaine. In the characterizatio n of the bands, and in the description of the torsion-inversion mode o f the p-amino group, the AM1 semiempirical method was used. The optimu m geometry parameters, the torsion and inversion potential functions, the energy levels, and the transitions were obtained. The effects of t emperature on the torsion and inversion modes were studied.