| Autor: |
Deiana, Carlo, Carla Aragoni, M., Isaia, Francesco, Lippolis, Vito, Pintus, Anna, Slawin, Alexandra M. Z., Derek Woollins, J., Arca, Massimiliano |
| Předmět: |
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| Zdroj: |
New Journal of Chemistry; Oct2016, Vol. 40 Issue 10, p8206-8210, 5p |
| Abstrakt: |
The choice of the metal ion M and the terminal Y and donor X chalcogen species (M = Ni, Pt; and X, Y = S, Se) in square-planar complexes deriving from 1,3-dimethyl-2-chalcogenoxo-imidazoline-4,5-dichalcogenolates allows fine-tuning of both the redox stability and the energy of the particularly intense NIR electrochromic absorption, thanks to the subtle contribution of M, X, and Y to the relevant frontier molecular orbitals, investigated at the IEF-PCM DFT and TD-DFT level. [ABSTRACT FROM AUTHOR] |
| Databáze: |
Complementary Index |
| Externí odkaz: |
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