X-Ray Crystallographic Analysis, EPR Studies, and Computational Calculations of a Cu(II) Tetramic Acid Complex

<div>Atomic charges calculated by natural population analysis at B3LYP/TZVP level of theory of (a) N-acetyl-3-acetyl-5-arylidenetetramic anion (TA-H<sup>+</sup>) and (b) copper(II) complex (only a part of the structure is presented here). “Mean” charges of various groups are denoted as bold numbers in brackets.</div>

Bioinorganic Chemistry and Applications

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Figure 5

Figure 5: X-Ray Crystallographic Analysis, EPR Studies, and Computational Calculations of a Cu(II) Tetramic Acid Complex 