Base information
| Cat. No. | |
| CAS No. | 502613-00-5 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C52H30N4Zn |
| Molecular Weight | 776.201 |
| Exact Mass | 774.176 |
| XLogP3 | 8.6487 |
| Mr | 243.729 |
| PSA | 72.42 |
| Sequence | - |
| Atom number | 87 |
| Bond number | 98 |
| Ring number | 12 |
| Rotor number | 4 |
| Residues number | 0 |
| Canonical smiles | C#Cc1ccc(cc1)C1=C2C=CC3=C(c4ccc(cc4)C#C)C4=N5[Zn+2]6([N-]23)N2=C1C=CC2=C(C1=CC=C([N-]61)C(=C5C=C4)c1ccc(cc1)C#C)c1ccc(cc1)C#C |
