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Tuning the Geometrical Structures and Optical Properties of Blue-Emitting Iridium(III) Complexes through Dimethylamine Substitutions: A Theoretical Study
The geometrical structures and photophysical properties of Ir(4,6-dFppy)(2)(pic) (FIrpic) and its derivative (o-FIr, m-FIr, p-FIr) with dimethylamine substituted at the picolinic acid (N(∧)O) ligand were fully investigated by density functional theory and time-dependent density functional theory. Th...
| Autores principales: | , , |
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| Formato: | Online Artículo Texto |
| Lenguaje: | English |
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MDPI
2017
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| Materias: | |
| Acceso en línea: | https://www.ncbi.nlm.nih.gov/pmc/articles/PMC6153745/ https://www.ncbi.nlm.nih.gov/pubmed/28481280 http://dx.doi.org/10.3390/molecules22050758 |