ZKP
FE3-S4 methylated cluster
Created: | 2021-05-01 |
Last modified: | 2021-09-15 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 11 |
Chiral Atom Count | 0 |
Bond Count | 13 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | FE3-S4 methylated cluster |
Formula | C H3 Fe3 S4 |
Molecular Weight | 310.83 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | CS[Fe]1S[Fe]S[Fe]S1 |
SMILES | OpenEye OEToolkits | 2.0.7 | C[S]1[Fe]2S[Fe]3[S]2[Fe]1S3 |
Canonical SMILES | CACTVS | 3.385 | CS[Fe]1S[Fe]S[Fe]S1 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | C[S]1[Fe]2S[Fe]3[S]2[Fe]1S3 |
InChI | InChI | 1.03 | InChI=1S/CH3S.3Fe.3S/c1-2;;;;;;/h1H3;;;;;; |
InChIKey | InChI | 1.03 | NMYMZQNZHUHIMW-UHFFFAOYSA-N |