Fc. Zhu et al., A DINUCLEAR COMPLEX OF THE THIOPURINE DRUG AZATHIOPRINE - [CU2CL4(MU-AZATHIOPRINE)(2)].4DMF, Acta crystallographica. Section C, Crystal structure communications, 54, 1998, pp. 773-776
In the title centrosymmetric dinuclear complex, lylthio)-7H-purine-N-3
:N-9]bis[dichlorocopper(II)] tetrakis(dimethylformamide) solvate, [Cu2
Cl4(C9H7N7O2S)(2)].4C(3)H(7)NO, the two Cu atoms are each coordinated
by two chloro and two N3:N9-bridging neutral azathioprine ligands. The
coordination geometry of each Cu atom is strongly distorted square pl
anar. The Cu ... Cu distance within the dinuclear unit is 2.939(2) Ang
strom. Azathioprine exhibits a conformation in which there is a trans
arrangement of the C5-C6 and S6-C10 bonds with respect to C6-S6, and i
n which the imidazole substituent at S6 points away from the imidazole
ring of the purine moiety. The imidazole plane is approximately perpe
ndicular to the purine plane, with a corresponding dihedral angle of 7
2.1 (3)degrees.