OEY
Summary
| Name: | CA-MN4-O6 CLUSTER |
| Formula: | Ca Mn4 O6 |
| Formal charge: | 0 |
| Formula weight: | 355.827 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/Ca.4Mn.O2.4O/c;;;;;1-2;;;;/q;;;;+1;-1;;;; |
| InChIKey | InChI | 1.03 | VXLJVOKMVCJEPF-UHFFFAOYSA-N |
| SMILES_CANONICAL | CACTVS | 3.385 | O1[Mn]O[O]23[Ca]O[Mn@]2(O[Mn]1)O[Mn]3 |
| SMILES | CACTVS | 3.385 | O1[Mn]O[O]23[Ca]O[Mn]2(O[Mn]1)O[Mn]3 |
| SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | O1O23[Ca]4O5[Mn]1O6[Mn]5O4[Mn]62O[Mn]3 |
| SMILES | OpenEye OEToolkits | 2.0.6 | O1O23[Ca]4O5[Mn]1O6[Mn]5O4[Mn]62O[Mn]3 |
