BF8
Summary
| Name: | FE(4)-NI(1)-S(5) CLUSTER with Oxygen |
| Formula: | Fe4 Ni O S4 |
| Formal charge: | 0 |
| Formula weight: | 426.333 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 |
| InChI | InChI | 1.03 | InChI=1S/4Fe.Ni.O.4S |
| InChIKey | InChI | 1.03 | DGNZLMZPCMYVGP-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O1[Fe]S[Fe]S[Fe]S[Fe]S[Ni]1 |
| SMILES | CACTVS | 3.385 | O1[Fe]S[Fe]S[Fe]S[Fe]S[Ni]1 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | O1[Fe][S]2[Fe]3[S]4[Fe]2[S]5[Fe]4[S]3[Ni]51 |
| SMILES | OpenEye OEToolkits | 2.0.6 | O1[Fe][S]2[Fe]3[S]4[Fe]2[S]5[Fe]4[S]3[Ni]51 |
