Base information
| Cat. No. | |
| CAS No. | 60489-13-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C44H36FeN8+++++ |
| Molecular Weight | 732.655 |
| Exact Mass | 732.241 |
| XLogP3 | 3.605 |
| Mr | 225.452 |
| PSA | 64.85 |
| Sequence | - |
| Atom number | 89 |
| Bond number | 96 |
| Ring number | 9 |
| Rotor number | 3 |
| Residues number | 0 |
| Canonical smiles | CN1C=C/C(=C/2\C3=N/C(=C(/c4cc[n+](cc4)C)\c4ccc([n-]4)/C(=C/4\N=C(/C(=C/5\N=C2C=C5)/c2cc[n+](cc2)C)C=C4)/c2cc[n+](cc2)C)/C=C3)/C=C1.[Fe+3] |
