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We present a structural analysis method for molecular and electronic structure of yttrium diethyldithiocarbamato‐phenanthroline complex {[Y(S2CNR2)3PHEN] with R = C2H5 and PHEN = 1,10‐phenanthroline} combining solid‐state NMR spectroscopy, XRD, and first principles DFT calculations. Replacing the Nd3+ ion with Y3+ in the reported crystal structure of [Nd(S2CNR2)3PHEN] complex generated an approximate...
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