NFV
Summary
| Name: | NI-FE OXIDIZED ACTIVE CENTER |
| Formula: | C3 Fe N2 Ni O2 |
| Formal charge: | 0 |
| Formula weight: | 210.583 Da |
| Component type: | NON-POLYMER |
| Ambiguous Chemistry Warning: | The chemical description of this component is not well described in this definition. Descriptors and chemical names should be used with caution. |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES_CANONICAL | CACTVS | 3.370 | [Ni]O[Fe](|[C-]#[O+])(C#N)C#N |
| SMILES | CACTVS | 3.370 | [Ni]O[Fe](|[C-]#[O+])(C#N)C#N |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.0 | C(#N)[Fe](C#N)(C#O)O[Ni] |
| SMILES | OpenEye OEToolkits | 1.7.0 | C(#N)[Fe](C#N)(C#O)O[Ni] |
| InChI | InChI | 1.03 | InChI=1S/2CN.CO.Fe.Ni.O/c3*1-2;;; |
| InChIKey | InChI | 1.03 | MPQMGFDSXFFIQL-UHFFFAOYSA-N |
