Synthesis and crystal structures of a new μ-bis(tetradentate) schiff base ligand and its mononuclear iron(III) complex: Iron(III) induced imidazolidine ring hydrolysis of binucleating schiff base ligand

Abstract

The μ-bis(tetradertate) ligand, [C27TH26OCl 3N4O4], 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)-triethylenetetramine have been synthesized and their crystal structures determined. Minimum energy conformations of the ligand were calculated (MOPAC, AM1) as a function of two torsion angles and the results compared with optimized crystal structure. The ligand (H3L′) reacts with Fe(ClO4) 2·6H2O 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. © 2005 Verlag der Zeitschrift für Naturforschung.