Sh. Ryu et al., SYNTHESIS, CHARACTERIZATION AND X-RAY CRYSTAL-STRUCTURE OF THE BENZENEDITHIOLATOHAFNIUM(IV) PORPHYRIN COMPLEX, Inorganica Chimica Acta, 221(1-2), 1994, pp. 51-54
A novel hafnium porphyrin complex Hf(TPP)(bdt) (TPP = 5,10,15,20-tetra
phenylporphyrinate; bdt=benzenedithiolate) was synthesized and charact
erized. The X-ray crystal structure of the complex revealed a six-coor
dinate Hf atom surrounded by 4 N atoms of the porphyrin and 2 S atoms
of the bdt ligand. The two sulfur atoms of the bdt are in an eclipsed
position with respect to the two opposite pyrrole nitrogen atoms of th
e porphyrin. Crystal data for Hf(TPP)(bdt): tetragonal, P4(1)2(1)2, a
= 12.471(2), c = 26.966(3) angstrom, V= 4038.2(7) angstrom3, Z = 4; R
= 0.054 and R(w) = 0.060 for 2673 independent reflections with I > 3si
gma(I).