FU8
Summary
| Name: | dicarbonyl[bis(cyanide-kappaC)]-mu-(ethanethiolatato-1kappaS:2kappaS)-mu-(ox omethylidene)diiron(2+) |
| Formula: | C7 H4 Fe2 N2 O3 S2 |
| Formal charge: | 2 |
| Formula weight: | 339.938 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/C2H4S2.2CN.3CO.2Fe/c3-1-2-4;5*1-2;;/h1-2H2;;;;;;;/q;;;;2*+1;; |
| InChIKey | InChI | 1.03 | MZEMAHMYMVUPIF-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O=C1[Fe](SCCS[Fe]1(C#N)C#[O+])(C#N)C#[O+] |
| SMILES | CACTVS | 3.385 | O=C1[Fe](SCCS[Fe]1(C#N)C#[O+])(C#N)C#[O+] |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | C1C[S]2[Fe]3([S]1[Fe]2(C3=O)(C#N)C#[O+])(C#N)C#[O+] |
| SMILES | OpenEye OEToolkits | 2.0.6 | C1C[S]2[Fe]3([S]1[Fe]2(C3=O)(C#N)C#[O+])(C#N)C#[O+] |
