Your browser doesn't support javascript.
loading
Mostrar: 20 | 50 | 100
Resultados 1 - 6 de 6
Filtrar
Mais filtros










Base de dados
Tipo de estudo
Intervalo de ano de publicação
1.
Artigo em Inglês | MEDLINE | ID: mdl-16524759

RESUMO

The electronic absorption spectra of some 6-chloro,2-pyridyl hydrazones are studied in seven organic solvents of different polarity. The absorption bands are assigned to the corresponding electronic transitions and the effect of solvent parameters on the charge transfer energy (E(CT)) is investigated. The spectra in buffer solutions of varied pH are also studied and utilized for the determination of the acid dissociation constants of the compounds under study. The fluorescence spectra were recorded for one of the studied compounds in six solvents, the solvent effect on the photoquantum yield and spectral pattern are also studied. Bands of diagnostic importance in the IR spectra and signals in the (1)H NMR spectra are assigned. The results of the present investigation are supported by some MO calculations using the atom super position and electron delocalization molecular orbital theory (ASED-MO) and Gaussian 94 program. The geometry is optimized using the PM3 method.


Assuntos
Hidrazonas/química , Espectroscopia de Ressonância Magnética , Conformação Molecular , Estrutura Molecular , Soluções , Solventes , Espectrometria de Fluorescência , Espectrofotometria Infravermelho , Espectrofotometria Ultravioleta
2.
Spectrochim Acta A Mol Biomol Spectrosc ; 62(1-3): 621-9, 2005 Nov.
Artigo em Inglês | MEDLINE | ID: mdl-16257767

RESUMO

Five Schiff bases derived from 4-aminoantipyrine and benzaldehyde derivatives (I) are prepared and their UV-vis, IR, (1)H NMR and fluorescence spectra are investigated and discussed. The electronic absorption spectra of the hydroxy 4-aminoantipyrine Schiff bases Ib and Ie as well as the fluorescence spectra of Ie are studied in the organic solvents of different polarity. The UV-vis absorption spectra of 4-aminoantipyrine Schiff bases Ib, Id and Ie are investigated in aqueous buffer solutions of varying pH and utilized for the determination of pK(a) and DeltaG of the ionization process. The reactions of the hydroxy compounds Ib and Ie with Ni(II) and Cu(II) ions are also studied. The results of spectral studies are supported by some molecular orbital calculations using an atom superposition and electron delocalization molecular orbital theory for a compound Ib.


Assuntos
Ampirona/química , Bases de Schiff/química , Anti-Inflamatórios não Esteroides/química , Espectroscopia de Ressonância Magnética/métodos , Modelos Moleculares , Conformação Molecular , Solventes , Espectrofotometria/métodos , Espectrofotometria Infravermelho , Espectrofotometria Ultravioleta
3.
Spectrochim Acta A Mol Biomol Spectrosc ; 62(4-5): 980-6, 2005 Dec.
Artigo em Inglês | MEDLINE | ID: mdl-15951233

RESUMO

The absorption spectra of mono- and bis-azo-derivatives obtained by coupling the diazonium salts of aromatic amines and 2,7-dihydroxynaphthalene have been studied in six organic solvents. The different absorption bands have been assigned and the effect of solvents on the charge transfer band is also discussed. The diagnostic IR spectral bands and 1H NMR signals are assigned and discussed in relation to molecular structure. Also, semi-empirical molecular orbital calculations using the atom superposition and electron delocalization molecular orbital (ASED-MO) theory have been performed to investigate the molecular and electronic structures of these compounds. According to these calculations, an intramolecular hydrogen bonding is essential for stabilization of such molecules.


Assuntos
Compostos de Anilina/química , Compostos Azo/química , Naftóis/química , Compostos Azo/síntese química , Espectroscopia de Ressonância de Spin Eletrônica , Ligação de Hidrogênio , Espectroscopia de Ressonância Magnética , Modelos Químicos , Estrutura Molecular , Espectrofotometria Infravermelho , Espectrofotometria Ultravioleta
4.
Spectrochim Acta A Mol Biomol Spectrosc ; 60(12): 2883-9, 2004 Oct.
Artigo em Inglês | MEDLINE | ID: mdl-15350925

RESUMO

The electronic absorption spectra of some bisazo-dianils are studied in organic solvents of different polarity and in buffer solutions of varied pH. The different absorption bands are assigned to the corresponding electronic transitions, the solvent effect on the CT band energy is also discussed. The spectral study in buffer solutions is utilized for the determination of the pKa of the phenolic OH-groups. The important bands in the IR spectra as well as the signals of the 1H NMR spectra are assigned and discussed in relation to molecular structure. The fluorescence spectra of the compounds are recorded. The fluorescence quantum yield and pK in the ground and excited states are determined.


Assuntos
Compostos Azo/química , Soluções Tampão , Concentração de Íons de Hidrogênio , Espectroscopia de Ressonância Magnética , Estrutura Molecular , Solventes , Espectrofotometria , Espectrofotometria Ultravioleta , Espectroscopia de Infravermelho com Transformada de Fourier
5.
Spectrochim Acta A Mol Biomol Spectrosc ; 59(2): 405-11, 2003 Jan 15.
Artigo em Inglês | MEDLINE | ID: mdl-12685914

RESUMO

Electronic absorption, and excitation spectra of 1-methyl-4-[4-aminostyryl] pyridinum iodide (M-NH2) were measured in solvents of different polarity. The (M-NH2) dye exhibits negative solvatochromism, i.e. a hypsochromic band shift as the solvent polarity increases. The fluorescence quantum yield is also sensitive to the polarity and viscosity of the medium. The ground and excited state protonation constants were calculated and amount to 3.35 and 0.62, respectively. The effect of micellization on the emission spectrum of (M-NH2) are also studied in sodium dodecyl sulphate (SDS). The fluorescence intensity increases as the concentration of SDS increases with an abrupt change at cmc. The quantum yield of the cis trans photoisomerization is also determined in aqueous buffer solution of pH 1.1.


Assuntos
Compostos de Piridínio/química , Espectrofotometria/métodos , Raios Ultravioleta , Concentração de Íons de Hidrogênio , Luz , Micelas , Modelos Químicos , Modelos Estatísticos , Compostos de Piridínio/análise , Dodecilsulfato de Sódio/farmacologia , Solventes , Espectrometria de Fluorescência
6.
Spectrochim Acta A Mol Biomol Spectrosc ; 59(4): 723-8, 2003 Mar 01.
Artigo em Inglês | MEDLINE | ID: mdl-12609620

RESUMO

The electronic absorption and emission spectra of the titled biazo-dianils are studied in organic solvents of different polarity as well as in aqueous buffer solutions of varying pH. The important bands in the IR spectra as well as the main signals of the 1H NMR spectra are assigned. The observed UV/Vis absorption bands are assigned to the corresponding electronic transitions. The fluorescence quantum yield and pK(a)(-) values in the ground and excited states are determined.


Assuntos
Aldeídos/análise , Compostos Azo/análise , Diaminas/análise , Espectroscopia de Ressonância Magnética/métodos , Espectrofotometria Infravermelho/métodos , Aldeídos/química , Compostos Azo/química , Corantes/química , Concentração de Íons de Hidrogênio , Cinética , Modelos Químicos , Espectrometria de Fluorescência , Espectrofotometria/métodos , Raios Ultravioleta
SELEÇÃO DE REFERÊNCIAS
DETALHE DA PESQUISA
...