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Comparative Study of the Structural and Vibroelectronic Properties of Porphyrin and Its Derivatives
Density functional theory (DFT and time-dependent-DFT (TD-DFT) were employed to investigate the vibroelectronic structural properties of porphyrin and some derivatives: unsubstituted porphyrin (TPyr), meso-tetraphenylporphyrin (TPP), meso-tetrakis(p-sulfonatophenyl)porphyrin (TSPP), protonated-TPyr...
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
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MDPI
2014
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| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6271358/ https://www.ncbi.nlm.nih.gov/pubmed/25517340 http://dx.doi.org/10.3390/molecules191220988 |