CLP
Summary
Name: | FE-S CLUSTER |
Formula: | Fe8 S8 |
Formal charge: | 0 |
Formula weight: | 703.28 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.S2.6S/c;;;;;;;;1-2;;;;;; |
InChIKey | InChI | 1.06 | MJXAKWFPOPRKKV-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | S1[Fe]S[Fe]2S[Fe][S]2([Fe]1)[S]34[Fe]S[Fe]S[Fe]3S[Fe]4 |
SMILES | CACTVS | 3.385 | S1[Fe]S[Fe]2S[Fe][S]2([Fe]1)[S]34[Fe]S[Fe]S[Fe]3S[Fe]4 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | [S]12[Fe]3[S]4[Fe]1S5([Fe]2[S]3[Fe]45)S67[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]1S5([Fe]2[S]3[Fe]45)S67[Fe]8[S]9[Fe]6[S]1[Fe]9[S]8[Fe]71 |