NWN
Summary
| Name: | hydrido[hydridonickel(2+)]bis(hydrocyanato-1kappaC)(hydroxymethyl)iron |
| Formula: | C3 H4 Fe N2 Ni O |
| Formal charge: | 1 |
| Formula weight: | 198.615 Da |
| Component type: | non-polymer |
Chemical Identifiers
| Program | Version | Name |
| ACDLabs | 12.01 | hydrido[hydridonickel(2+)]bis(hydrocyanato-1kappaC)(hydroxymethyl)iron |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| SMILES | ACDLabs | 12.01 | [Ni+2][H-][Fe](C#N)(C#N)CO |
| InChI | InChI | 1.03 | InChI=1S/2CN.CH3O.Fe.Ni.H/c3*1-2;;;/h;;2H,1H2;;;/q;;;;+2;-1 |
| InChIKey | InChI | 1.03 | ZUFDVORDBCYGRI-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | [Ni++][H-][Fe](CO)(C#N)C#N |
| SMILES | CACTVS | 3.385 | [Ni++][H-][Fe](CO)(C#N)C#N |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | [H-]([Fe](CO)(C#N)C#N)[Ni+2] |
| SMILES | OpenEye OEToolkits | 1.7.6 | [H-]([Fe](CO)(C#N)C#N)[Ni+2] |
