Obsolete: 3OF
Summary
Name: | HYDRATED FE (III) ION, 2 WATERS COORDINATED |
Formula: | Fe H4 O2 |
Formal charge: | 3 |
Formula weight: | 91.876 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 | 1.02b | InChI=1/Fe.2H2O/h;2*1H2/q+3;;/rFeH4O2/c2-1-3/h2-3H2/q+3 |
InChIKey | InChI | 1.02b | SZDOSDXWAOBQFH-SWXSXKEPAZ |
SMILES_CANONICAL | CACTVS | 3.341 | O|[Fe+3]|O |
SMILES | CACTVS | 3.341 | O|[Fe+3]|O |
SMILES_CANONICAL | OpenEye OEToolkits | 1.5.0 | [OH2][Fe+3][OH2] |
SMILES | OpenEye OEToolkits | 1.5.0 | [OH2][Fe+3][OH2] |