ZEITSCHRIFT FUR NATURFORSCHUNG SECTION B-A JOURNAL OF CHEMICAL SCIENCES, vol.60, no.5, pp.520-526, 2005 (SCI-Expanded)
The mu-bis(tetradentate) ligand, [C27H26Cl3N4O4], H3L', 1,3-bis[N-(5-chloro-2-hydroxybenzylidene)-2-aminoethyl]-2-(5-chloro-2-hydroxyphenyl)imidazolidine and its mononuclear iron(III) complex, [Fe(L)](ClO4), L = N, N'-bis(5-chloro-2-hydroxybenzylidene)-triethylenctetramine have been synthesized and their crystal structures determined. Minimum energy conformations of the ligand were calculated (MOPAC, AMl) as a function of two torsion angles and the results compared with optimized crystal structure. The ligand (H3L') reacts with Fe(ClO4)(2) (.) 6H(2)O in aqueous methanol to form the mononuclear [Fe(L)](ClO4) complex with the imidazolidine ring cleaved by hydrolysis. The complex has an N4O2 donor atom set forming a distorted octahedral coordination geometry around the metal atom as established from a crystal structure determination. The terminal oxygen donor atoms occupy cis positions, and the remaining four nitrogen atoms (two cis amine and two trans imine) complete the coordination sphere.