A Theoretical Study of Chemical Reactivity of Tartrazine Through DFT Reactivity Descriptors
In this work we have calculated global and local DFT re - activity descriptors for tartrazine at B3LYP/6-311++G (2d,2p) level. Global reactivity descriptors such as ionization energy, molecular hardness, electrophilicity, and total energies were calculated to evalu - ate the tartrazine reactivity in...
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| Publicado no: | Journal of the Mexican Chemical Society |
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| Autor principal: | |
| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
Sociedad Química de México
2014
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| Assuntos: | |
| Acesso em linha: | https://www.redalyc.org/articulo.oa?id=47535733007 |
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