Base information
| Cat. No. | |
| CAS No. | 64696-98-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H12N4NiO2 |
| Molecular Weight | 375.007 |
| Exact Mass | 374.031 |
| XLogP3 | 3.07056 |
| Mr | 95.1664 |
| PSA | 129.42 |
| Sequence | - |
| Atom number | 37 |
| Bond number | 41 |
| Ring number | 5 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | N#CC1=C(C#N)N2=Cc3c([O-][Ni+2]42N1=Cc1ccccc1[O-]4)cccc3 |
