Chemical Component Summary

Name[29H,31H-phthalocyaninato(2-)-kappa~4~N~29~,N~30~,N~31~,N~32~]iron
SynonymsPhthalocyanine containing Fe
Identifiersn/a
FormulaC32 H16 Fe N8
Molecular Weight568.368
TypeNON-POLYMER
Isomeric SMILESc1ccc2c(c1)c3nc-4[n+]5c(nc6c7ccccc7c8n6[Fe]59n3c2nc-1[n+]9c(n8)-c2c1cccc2)-c1c4cccc1
InChIInChI=1S/C32H16N8.Fe/c1-2-10-18-17(9-1)25-33-26(18)38-28-21-13-5-6-14-22(21)30(35-28)40-32-24-16-8-7-15-23(24)31(36-32)39-29-20-12-4-3-11-19(20)27(34-29)37-25;/h1-16H;/q-2;+4
InChIKeyOZJJLOPWWRQASN-UHFFFAOYSA-N

Chemical Details

Formal Charge2
Atom Count57
Chiral Atom Count0
Bond Count68
Aromatic Bond Count28

Related Resource References

Resource NameReference
PubChem 15820886
CCDC/CSD FEPHCY03, FEPHCY04, FEDXUH