Base information
| Cat. No. | |
| CAS No. | 148423-37-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C39H36Cl2Zr |
| Molecular Weight | 666.833 |
| Exact Mass | 664.124 |
| XLogP3 | 10.5917 |
| Mr | 176.818 |
| PSA | 0 |
| Sequence | - |
| Atom number | 78 |
| Bond number | 92 |
| Ring number | 15 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | CC(C1=C[C]23=[C]4(C=C1)[Zr+4]156789%102([CH-]3([C]2%10=[C]41C=CC(=C2)C(C)(C)C)C([CH-]19C5=C8C7=C61)(c1ccccc1)c1ccccc1)([Cl-])[Cl-])(C)C |
