Base information
| Cat. No. | |
| CAS No. | 1330-38-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C32H14CuN8Na2O6S2 |
| Molecular Weight | 780.159 |
| Exact Mass | 778.957 |
| XLogP3 | 1.4317 |
| Mr | 191.307 |
| PSA | 215.18 |
| Sequence | - |
| Atom number | 65 |
| Bond number | 72 |
| Ring number | 10 |
| Rotor number | 2 |
| Residues number | 0 |
| Canonical smiles | [O-]S(=O)(=O)c1ccc2c(c1)C1=N/C/2=N\c2c3ccccc3c3n2[Cu]n2/c(=N\1)/c1ccccc1/c/2=N/C1=N/C(=N\3)/c2c1ccc(c2)S(=O)(=O)[O-].[Na+].[Na+] |
