SpectraBase Spectrum ID |
GpoSfahoiMI |
Name |
Iron, (benzenesulfonato-O)[5,10,15,20-tetraphenyl-21H,23H-porphinato(2-)-N21,N22,N23,N24]-, (SP-5-12)- |
CAS Registry Number |
91071-34-0 |
Copyright |
Copyright © 2020-2024 John Wiley & Sons, Inc. All Rights Reserved. |
Formula |
C50H33FeN4O3S |
InChI |
InChI=1S/C44H28N4.C6H6O3S.Fe/c1-5-13-29(14-6-1)41-33-21-23-35(45-33)42(30-15-7-2-8-16-30)37-25-27-39(47-37)44(32-19-11-4-12-20-32)40-28-26-38(48-40)43(31-17-9-3-10-18-31)36-24-22-34(41)46-36;7-10(8,9)6-4-2-1-3-5-6;/h1-28H;1-5H,(H,7,8,9);/q-2;;+3/p-1/b41-33-,41-34-,42-35-,42-37-,43-36-,43-38-,44-39-,44-40-;; |
InChIKey |
CSPYVBCVNFDBGU-YKKPBKTHSA-M |
Molecular Weight |
825.744 g/mol |
SMILES |
c12[n]3[Fe]([n]4c(c(c5ccc(c2-c2ccccc2)n5)-c2ccccc2)ccc4c(c2nc(c(c3cc1)-c1ccccc1)cc2)-c1ccccc1)OS(=O)(=O)c1ccccc1 |
SPLASH |
splash10-014i-0000009000-b8c30082dea609b5b503 |
Source of Spectrum |
KA-1984-571-4 |
Synonyms |
2,7,12,17-tetraphenyl-21,23,24,25-tetraaza-22-ferrahexacyclo[9.9.3.1(3,6).1(13,16).0(8,23).0(18,21)]pentacosa-1,3(25),4,6,8,10,12,14,16(24),17,19-undecaen-22-yl benzenesulfonate
21H,23H-porphine, 5,10,15,20-tetraphenyl-, iron complex
Benzenesulfonic acid, iron complex
Phenylsulfonato(5,10,15,20-tetraphenylporphyrinato)iron |
Wiley ID |
1417487 |