Nitrosyl(protoporphyrin IX dimethyl ester)iron II
[CAS# 74936-44-0]

Identification

• Name: Nitrosyl(protoporphyrin IX dimethyl ester)iron II
• Synonyms: Iron(1+), (Dimethyl 7,12-Diethenyl-3,8,13,17-Tetramethyl-21H,23H-Porphine-2,18-Dipropanoato(2-)-N21,N22,N23,N24)Nitrosyl-, (Sp-5-13)-; Nitrosyl(Protoporphyrin Ix Dimethyl Ester)Iron Ii
• Molecular Formula: C₃₆H₃₆FeN₅O₅
• Molecular Weight: 674.56
• CAS Registry Number: 74936-44-0
• SMILES: [O+]#N.N1=C3C(=C(C1=CC5=NC(=CC2=C(C(=C([N-]2)C=C4[N-]C(=C3)C(=C4C)CCC(OC)=O)C)C=C)C(=C5C=C)C)C)CCC(OC)=O.[Fe++]
• InChI: 1S/C36H36N4O4.Fe.NO/c1-9-23-19(3)27-15-28-21(5)25(11-13-35(41)43-7)33(39-28)18-34-26(12-14-36(42)44-8)22(6)30(40-34)17-32-24(10-2)20(4)29(38-32)16-31(23)37-27;;1-2/h9-10,15-18H,1-2,11-14H2,3-8H3;;/q-2;+2;+1
• InChIKey: VQOSQBYIUPQNJK-UHFFFAOYSA-N