Base information
| Cat. No. | |
| CAS No. | 286475-30-7 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C48H58ClMnN12++++ |
| Molecular Weight | 893.446 |
| Exact Mass | 892.398 |
| XLogP3 | 2.2452 |
| Mr | 267.67 |
| PSA | 107.66 |
| Sequence | - |
| Atom number | 120 |
| Bond number | 130 |
| Ring number | 12 |
| Rotor number | 12 |
| Residues number | 0 |
| Canonical smiles | CCn1cc[n+](c1C1=C2C=CC3=C(c4n(CC)cc[n+]4CC)C4=N5[Mn+3]6([N-]23)N2=C1C=CC2=C(C1=CC=C([N-]61)C(=C5C=C4)c1n(CC)cc[n+]1CC)c1n(CC)cc[n+]1CC)CC.[Cl-] |
