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The structures and electronic absorption spectra of newly synthesized heteroleptic copper (I) complexes [CuL 1 L 2 ] + (L 1 =phen-imidazole and/or L 2 =dipyrido [3,2-a:2’,3’-c] phenazine derivatives) are analyzed under the light of density functional theory (DFT) and time-dependent DFT (TD-DFT). The ground states geometries, characterized by π-stacking interactions,...
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