Base information
| Cat. No. | |
| CAS No. | 14634-91-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C36H24FeN6O4S |
| Molecular Weight | 692.524 |
| Exact Mass | 692.093 |
| XLogP3 | 8.0893 |
| Mr | 181.651 |
| PSA | 165.98 |
| Sequence | - |
| Atom number | 72 |
| Bond number | 76 |
| Ring number | 9 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | c1ccc2c(n1)c1ncccc1cc2.c1ccc2c(n1)c1ncccc1cc2.c1ccc2c(n1)c1ncccc1cc2.[O-]S(=O)(=O)[O-].[Fe+2] |
