| Journal: | Brazilian journal of physics |
| Database: | PERIÓDICA |
| System number: | 000403370 |
| ISSN: | 0103-9733 |
| Authors: | Bento, R.R.F1 Freire, P.T.C2 Teixeira, A.M.R3 Silva, J.H3 Lima-Junior, J.A4 Oliveira, M.C.F. de5 Andrade-Neto, M5 Romero, N.R6 Pontes, F.M7 |
| Institutions: | 1Universidade Federal de Mato Grosso, Instituto de Fisica, Cuiaba, Mato Grosso. Brasil 2Universidade Federal do Ceara, Departamento de Fisica, Fortaleza, Ceara. Brasil 3Universidade Regional do Cariri, Departamento de Ciencias Fisicas e Biologicas, Crato, Ceara. Brasil 4Universidade Estadual do Ceara, Limoeiro do Norte, Ceara. Brasil 5Universidade Federal do Ceara, Departamento de Quimica Organica e Inorganica, Fortaleza, Ceara. Brasil 6Universidade Federal do Ceara, Departamento de Farmacia, Fortaleza, Ceara. Brasil 7Universidade Federal do Ceara, Faculdade de Ciencias, Fortaleza, Ceara. Brasil |
| Year: | 2009 |
| Season: | Mar |
| Volumen: | 39 |
| Number: | 1 |
| Pages: | 62-68 |
| Country: | Brasil |
| Language: | Inglés |
| Document type: | Artículo |
| Approach: | Analítico |
| English abstract | Pilocarpine is a natural substance with potential application in the treatment of several diseases. In this work Fourier Transform (FT)-Raman spectrum and the Fourier Transform infra red (FT-IR) spectrum of pilocarpine hydrochloride C11H17N2O + 2 .Cl− were investigated at 300 K. Vibrational wavenumber and wave vector have been predicted using density functional theory (B3LYP) calculations with the 6-31 G(d,p) basis set. A comparison with experiment allowed us to assign most of the normal modes of the crystal |
| Disciplines: | Física y astronomía, Matemáticas |
| Keyword: | Física, Matemáticas aplicadas, Pilocarpina, Transformada de Fourier, Dispersión Raman, Espectroscopía infrarroja |
| Keyword: | Physics and astronomy, Mathematics, Physics, Applied mathematics, Pilocarpine, Fourier transform, Raman scattering, Infrared spectroscopy |
| Full text: | Texto completo (Ver PDF) |
