CLF
Summary
| Name: | FE(8)-S(7) CLUSTER |
| Formula: | Fe8 S7 |
| Formal charge: | 0 |
| Formula weight: | 671.215 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 | 1.06 | InChI=1S/8Fe.7S |
| InChIKey | InChI | 1.06 | JKVMXLBGZBULKV-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | S1[Fe]S[Fe]2S[Fe][S]234([Fe]1)[Fe]S[Fe]S[Fe]3S[Fe]4 |
| SMILES | CACTVS | 3.385 | S1[Fe]S[Fe]2S[Fe][S]234([Fe]1)[Fe]S[Fe]S[Fe]3S[Fe]4 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | [S]12[Fe]3[S]4[Fe]1S567([Fe]2[S]3[Fe]45)[Fe]8[S]9[Fe]6[S]1[Fe]9[S]8[Fe]71 |
| SMILES | OpenEye OEToolkits | 2.0.7 | [S]12[Fe]3[S]4[Fe]1S567([Fe]2[S]3[Fe]45)[Fe]8[S]9[Fe]6[S]1[Fe]9[S]8[Fe]71 |
