S3F
Summary
| Name: | oxidized [Fe4-S3] cluster |
| Formula: | Fe4 O S3 |
| Formal charge: | 0 |
| Formula weight: | 335.574 Da |
| Component type: | NON-POLYMER |
Chemical Identifiers
| Program | Version | Name |
| OpenEye OEToolkits | 1.7.6 | (2-$l^{1}-oxidanyl-1$l^{3},3$l^{3},5-trithia-2$l^{3},4$l^{3},6$l^{2}-triferrabicyclo[2.2.0]hexan-3-yl)iron |
Chemical Descriptors
| Type | Program | Version | Descriptor |
| InChI | InChI | 1.03 | InChI=1S/4Fe.H2O.3S/h;;;;1H2;;;/q;;;+1;;;;/p-1 |
| InChIKey | InChI | 1.03 | ROWMPBKAWWBNCP-UHFFFAOYSA-M |
| SMILES_CANONICAL | CACTVS | 3.370 | O|[Fe]|1S|2[Fe]S[Fe]|2S|1[Fe] |
| SMILES | CACTVS | 3.370 | O|[Fe]|1S|2[Fe]S[Fe]|2S|1[Fe] |
| SMILES_CANONICAL | OpenEye OEToolkits | 1.7.6 | [O][Fe]1[S]([Fe]2[S]1[Fe]S2)[Fe] |
| SMILES | OpenEye OEToolkits | 1.7.6 | [O][Fe]1[S]([Fe]2[S]1[Fe]S2)[Fe] |
