Base information
| Cat. No. | |
| CAS No. | 1435909-76-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C46H41F4IrN3O2 |
| Molecular Weight | 936.047 |
| Exact Mass | 936.276 |
| XLogP3 | 10.638 |
| Mr | 227.349 |
| PSA | 105.69 |
| Sequence | - |
| Atom number | 97 |
| Bond number | 106 |
| Ring number | 10 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | Cc1cc(C)c(c(c1)C)C1=CC=N2C(=C1)C1=C(F)C=C(C=[CH-]1[Ir+3]132([O-]C(=O)C2=CC=CC=N12)[CH-]1=CC(=CC(=C1C1=CC(=CC=N31)c1c(C)cc(cc1C)C)F)F)F |
