Iron (II) Meso-Tetra(alpha,alpha,alpha,alpha-o-Pivalamidophenyl)Porphyrin
[CAS# 52629-13-7]

Identification

• Name: Iron (II) Meso-Tetra(alpha,alpha,alpha,alpha-o-Pivalamidophenyl)Porphyrin
• Synonyms: Fe(Ii)Tpp; Iron (Ii) Meso-Tetra(Alpha,Alpha,Alpha,Alpha-O-Pivalamidophenyl)Porphyrin; Iron, ((N,N',N'',N'''-(21H,23H-Porphine-5,10,15,20-Tetrayltetra-2,1-Phenylene)Tetrakis(2,2-Dimethylpropanamidato))(2-)-N21,N22,N23,N24)-, (Sp-4-1)-
• Molecular Formula: C₆₄H₆₄FeN₈O₄
• Molecular Weight: 1065.11
• CAS Registry Number: 52629-13-7
• SMILES: [NH]2C3=C(C1=CC=C([NH]1)C(=C7N=C(C(=C5N=C(C(=C2C=C3)C4=CC=CC=C4NC(=O)C(C)(C)C)C=C5)C6=CC=CC=C6NC(=O)C(C)(C)C)C=C7)C8=CC=CC=C8[N-]C(=O)C(C)(C)C)C9=CC=CC=C9[N-]C(=O)C(C)(C)C.[Fe++]
• InChI: 1S/C64H66N8O4.Fe/c1-61(2,3)57(73)69-41-25-17-13-21-37(41)53-45-29-31-47(65-45)54(38-22-14-18-26-42(38)70-58(74)62(4,5)6)49-33-35-51(67-49)56(40-24-16-20-28-44(40)72-60(76)64(10,11)12)52-36-34-50(68-52)55(48-32-30-46(53)66-48)39-23-15-19-27-43(39)71-59(75)63(7,8)9;/h13-36H,1-12H3,(H6,65,66,67,68,69,70,71,72,73,74,75,76);/q;+2/p-2
• InChIKey: XXLDFDYKIOQXLD-UHFFFAOYSA-L