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Electronic absorption and emission data of M(CO) 4 (phen) complexes, where M=Cr, Mo or W; phen=1,10-phenanthroline are reported using density functional theory (DFT). Electronic absorption spectra of [M(CO) 4 (phen)] show a strong band in the visible region of the spectrum, whose metal to ligand charge transfer (MLCT) M→phen and M→CO ax character is indicated by high molar...
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