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Time-dependent density functional theory calculations of the solvatochromism of some azo sulfonamide fluorochromes

The absorption and emission spectra of three azo sulfonamide compounds in different solvents were investigated theoretically by using response functions combined with density functional theory (DFT), while the solvent effect on the structure and the electronic transitions was determined using the in...

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Detalles Bibliográficos
Autor principal: Krawczyk, Przemysław
Formato: Online Artículo Texto
Lenguaje:English
Publicado: Springer Berlin Heidelberg 2015
Materias:
Acceso en línea:https://www.ncbi.nlm.nih.gov/pmc/articles/PMC4427650/
https://www.ncbi.nlm.nih.gov/pubmed/25877526
http://dx.doi.org/10.1007/s00894-015-2651-z