NFR
Summary
| Name: | NI-FE REDUCED ACTIVE CENTER |
| Formula: | C3 H2 Fe N Ni O2 |
| Formal charge: | 0 |
| Formula weight: | 198.592 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 10.04 | diformyl(hydrocyanato-1kappaC)ironnickel(Fe-Ni) |
| OpenEye OEToolkits | 1.5.0 | (cyano-dimethanoyl-ferrio)nickel |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 10.04 | N#C[Fe]([Ni])(C=O)C=O |
| SMILES_CANONICAL | CACTVS | 3.341 | [Ni]|[Fe](C=O)(C=O)C#N |
| SMILES | CACTVS | 3.341 | [Ni]|[Fe](C=O)(C=O)C#N |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | C(=O)[Fe](C=O)(C#N)[Ni] |
| SMILES | OpenEye OEToolkits | 1.5.0 | C(=O)[Fe](C=O)(C#N)[Ni] |
| InChI | InChI | 1.03 | InChI=1S/CN.2CHO.Fe.Ni/c3*1-2;;/h;2*1H;; |
| InChIKey | InChI | 1.03 | WWDMWDTTWHCODG-UHFFFAOYSA-N |
