Base information
| Cat. No. | |
| CAS No. | 15321-51-4 |
| Product Name | |
| MDL. |
Computed Properties
| Property Name | Property Value |
| Molecular Formula | C9Fe2O9 |
| Molecular Weight | 363.781 |
| Exact Mass | 363.824 |
| XLogP3 | -1.8989 |
| Mr | 44.5275 |
| PSA | 51.21 |
| Sequence | - |
| Atom number | 20 |
| Bond number | 22 |
| Ring number | 3 |
| Rotor number | 0 |
| Residues number | 0 |
| Canonical smiles | O=[C-2]1[Fe+3]23([Fe+3]1([C-2]2=O)([C-2]3=O)(C#[O])(C#[O])C#[O])(C#[O])(C#[O])C#[O] |
