(SP-4-1)-((4,4',4'',4'''-(21H,23H-Porpine-5,10,15,20-tetrayl)tetrakis(benzenaminato))(2-)-N21,N22,N23,N24)iron(1+) chloride
Basic information
- CAS
87097-67-4- Standard SMILES
Nc1ccc(-c2c3nc(c(-c4ccc(N)cc4)c4ccc([n-]4)c(-c4ccc(N)cc4)c4nc(c(-c5ccc(N)cc5)c5ccc2[n-]5)C=C4)C=C3)cc1.[Cl-].[Fe+3]- InChIKey
OZGYLUYIRMENLZ-UHFFFAOYSA-M- Molecular formula
- C44H32ClFeN8
- Average molar mass
- 764.1 g/mol
- Monoisotopic mass
- 763.178781
Names & identifiers
- Preferred name
- (SP-4-1)-((4,4',4'',4'''-(21H,23H-Porpine-5,10,15,20-tetrayl)tetrakis(benzenaminato))(2-)-N21,N22,N23,N24)iron(1+) chloride
- IUPAC
- iron(3+);4-[10,15,20-tris(4-aminophenyl)porphyrin-22,24-diid-5-yl]aniline;chloride
Names & synonyms
99651-88-487097-67-4(SP-4-1)-((4,4',4'',4'''-(21H,23H-Porpine-5,10,15,20-tetrayl)tetrakis(benzenaminato))(2-)-N21,N22,N23,N24)iron(1+) chlorideIron(1+), ((4,4',4'',4'''-(21H,23H-porpine-5,10,15,20-tetrayl)tetrakis(benzenaminato))(2-)-N21,N22,N23,N24)-, chloride, (SP-4-1)-MFCD03453186C44H32ClFeN85,10,15,20-Tetrakis-(4-aminophenyl)-porphyrin-Fe-(III) chlorideferric;4-[10,15,20-tris(4-aminophenyl)porphyrin-22,23-diid-5-yl]aniline;chloride
Database identifiers
- CAS
87097-67-4- PubChem CID
- 174609
Properties
Computed structural properties
- Topological polar surface area
- 132 Ų
- Hydrogen bond donors
- 4
- Hydrogen bond acceptors
- 9
- Rotatable bonds
- 4
- Heavy atoms
- 54
- Formal charge
- 0
- Complexity
- 921
Suppliers
Loading…
Open inquiries
Loading…
Related reactions
0 records
No reaction records under the current filter.
Compound notes
Loading…