Base information
| Cat. No. | |
| CAS No. | 69138-22-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C34H33FeN4NaO6-- |
| Molecular Weight | 672.484 |
| Exact Mass | 672.165 |
| XLogP3 | 0.9771 |
| Mr | 177.66 |
| PSA | 192.81 |
| Sequence | - |
| Atom number | 79 |
| Bond number | 85 |
| Ring number | 8 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | C=CC1=C2C=C3C(=C(C4=N3[Fe+2]35[N-]2C(=C1C)C=C1N3=C(C(C1C)CCC(=O)[O-])C(=C1[N-]5C(=C4)C(=C1C(=O)[O-])C)CC(=O)[O-])CC)C.[Na+] |
