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DFT Study on the Substituent Effect of Anticancer Picoline-Diazido-Pt(IV) Compounds
The geometric structure of azido Pt(IV) compounds containing picoline was calculated by using density functional theory(DFT) at the LSDA/SDD level. The ESP distribution shows the possible reaction sites of the compounds. In addition, the frequency calculation results assigned the infrared spectra of...
| Autores principales: | , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
| Publicado: |
Frontiers Media S.A.
2022
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC8784384/ https://www.ncbi.nlm.nih.gov/pubmed/35083137 http://dx.doi.org/10.3389/fonc.2021.749178 |