Aplicacao de metodos quimiometricos na especiacao de Cr(VI) em solucao aquosa



Document title: Aplicacao de metodos quimiometricos na especiacao de Cr(VI) em solucao aquosa
Journal: Quimica nova
Database: PERIÓDICA
System number: 000196206
ISSN: 0100-4042
Authors: 1


Institutions: 1Universidade Estadual de Campinas, Instituto de Quimica, Campinas, Sao Paulo. Brasil
2Universidade Estadual de Londrina, Departamento de Química, Londrina, Parana. Brasil
Year:
Season: May-Jun
Volumen: 24
Number: 3
Pages: 331-338
Country: Brasil
Language: Portugués
Document type: Artículo
Approach: Experimental, descriptivo
English abstract The equilibria, the spectra and the identities of the species of Cr(VI) that are present in aqueous solution have long been an active subject of discussion in the literature. In this paper, three different chemometric methodologies are applied to sets of UV/Visible spectra of aqueous Cr(VI) solutions, in order to solve a chemical system where there is no available information concerning the composition of the samples nor spectral information about the pure species. Imbrie Q-mode factor analysis, followed by varimax rotation and Imbrie oblique projection, were used to estimate the composition of Cr(VI) equilibrium solutions and, by combining these results with the k-matrix method, to obtain the pure spectra of the species. Evolving factor analysis and self modeling curve resolution were used to confirm the number of the species and the resolution of the system, respectively. Sets of 3.3´10-4 and 3.3´10-5 mol L-1 Cr(VI) solutions, respectively, were analyzed in the pH range from 1 to 12. Two factors were identified, which were related to the chromate ion (CrO42-) and bichromate ion (HCrO4-). The pK of the equilibrium was estimated as 5.8
Disciplines: Química
Keyword: Química inorgánica,
Cromo,
Soluciones acuosas de cromo,
Rotación varimax,
Equilibrio,
Q de Imbrie,
Proyección oblícua de Imbrie
Keyword: Chemistry,
Inorganic chemistry,
Chromium,
Aquos chromium solutions,
Varimax rotation,
Equilibrium,
Imbrie Q,
Imbrie oblique projection
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