Base information
| Cat. No. | |
| CAS No. | 40759-64-6 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C18H20NiO2 |
| Molecular Weight | 327.044 |
| Exact Mass | 326.082 |
| XLogP3 | 4.2306 |
| Mr | 77.522 |
| PSA | 34.14 |
| Sequence | - |
| Atom number | 41 |
| Bond number | 48 |
| Ring number | 8 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | O=C1[C]2(=[C]3([Ni]45672([C]1(=[C]4(C3=O)C)C)C1=C7CCC5=C6CC1)C)C |
