Saddle-shaped six-coordinate iron(iii) porphyrin complex with unusual intermediate-spin electronic structure.
An unusual intermediate-spin electronic structure d(xz,yz)(3)d(xy)(1)d(z(2))(1) has been assigned to the six-coordinate saddled [Fe(OETPP)(4-CNPy)(2)](+) complex through density functional calculation and NMR spectroscopy analysis.
Cheng
Ru-Jen
RJ
Department of Chemistry, National Chung-Hsing University, Taichung, Taiwan 402, Republic of China. rjcheng@mail.nchu.edu.tw
Chao
Chia-Wei
CW
Han
Ya-Ping
YP
Chen
Yen-Chou
YC
Ting
Chiao-Han
CH
D005290:Ferric Compounds / Q000737:chemistry*; D008958:Models, Molecular; D015394:Molecular Structure; D011166:Porphyrins / Q000737:chemistry*
D005290:Ferric Compounds; D011166:Porphyrins