Base information
| Cat. No. | |
| CAS No. | 15489-90-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C34H32FeN4O5- |
| Molecular Weight | 633.495 |
| Exact Mass | 633.18 |
| XLogP3 | 2.9685 |
| Mr | 177.569 |
| PSA | 169.75 |
| Sequence | - |
| Atom number | 77 |
| Bond number | 83 |
| Ring number | 8 |
| Rotor number | 8 |
| Residues number | 0 |
| Canonical smiles | C=CC1=C(C)C2=CC3=N4[Fe+3]56([N-]2C1=CC1=N5C(=CC2=C(C(=C([N-]62)C=C4C(=C3C)CCC(=O)[O-])CCC(=O)[O-])C)C(=C1C)C=C)[O-].[H+] |
