Base information
| Cat. No. | |
| CAS No. | 1273-84-3 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C11H9FeN |
| Molecular Weight | 211.041 |
| Exact Mass | 211.008 |
| XLogP3 | 1.93428 |
| Mr | 47.556 |
| PSA | 23.79 |
| Sequence | - |
| Atom number | 22 |
| Bond number | 21 |
| Ring number | 2 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | [CH]1[CH][CH][CH][CH]1.N#C[C]1[CH][CH][CH][CH]1.[Fe] |
