Base information
| Cat. No. | |
| CAS No. | 162157-04-2 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C19H9FeNO |
| Molecular Weight | 323.126 |
| Exact Mass | 323.003 |
| XLogP3 | 1.9035 |
| Mr | 85.122 |
| PSA | 21.59 |
| Sequence | - |
| Atom number | 31 |
| Bond number | 42 |
| Ring number | 12 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | c1ccc(cc1)[C@H]1COC(=N1)[CH-]12C3=C4[Fe+2]5678923(C1=C45)[c-]1c6c8c9c71 |
