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We have reported the synthesis of compounds mentioned in this paper and the characterization of their structure and properties withspectra7]. In this Work, we made a quantum chemistry calculation of Cu(En)2DDQ2, Cu(Phen)2DDQ2 and three analogous compoundsof Zn2+ coordinated with Phen, Bipy, and En ligands in octahedral model; discussed the feature of their chemical bonds. The resultObtained shows that DDQ radical anion is a considerable electron acceptor. It also would be helpful to understand the characteristics ofIR, ESR spectra of bile compounds and their conductivity discovered in solid state or solution.
We have reported the synthesis of compound mentioned in this paper and the characterization of their structure and properties with spectra 7]. In this Work, we made a quantum chemistry calculation of Cu (En) 2DDQ2, Cu (Phen) 2DDQ2 and three analogous compounds of Zn2 + coordinated with Phen, Bipy, and En ligands in octahedral model; discussed the feature of their chemical bonds. The resultObtained shows that DDQ radical anion is a considerable electron acceptor. It also would be helpful to understand the characteristics of IR, ESR spectra of bile compounds and their conductivity discovered in solid state or solution.