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DFT Study on the Radical Anions Formed by Primaquine and Its Derivatives
The electron affinities (EA) of the 8-aminoquinoline antimalarial drug primaquine and several of its metabolites were studied using the density functional theory method. We first considered six substituents at the 5-position, −CH(3), −OH, −OCH(3), −Ph, −OPh and −CHO. We found that in the gas phase t...
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| Main Authors: | , , |
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| Formato: | Artigo |
| Idioma: | Inglês |
| Publicado em: |
2011
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| Assuntos: | |
| Acesso em linha: | https://ncbi.nlm.nih.gov/pmc/articles/PMC3443493/ https://ncbi.nlm.nih.gov/pubmed/21699254 https://ncbi.nlm.nih.govhttp://dx.doi.org/10.1021/tx200094v |
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