ICZ
iron-sulfur-molybdenum cluster with interstitial carbon
Created: | 2019-09-26 |
Last modified: | 2020-06-24 |
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Chemical Details | |
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Formal Charge | 0 |
Atom Count | 16 |
Chiral Atom Count | 0 |
Bond Count | 26 |
Aromatic Bond Count | 0 |
Chemical Component Summary | |
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Name | iron-sulfur-molybdenum cluster with interstitial carbon |
Formula | C Fe7 Mo S7 |
Molecular Weight | 723.321 |
Type | NON-POLYMER |
Chemical Descriptors | |||
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Type | Program | Version | Descriptor |
SMILES | CACTVS | 3.385 | S1[Fe]S[Fe]2S[Fe]3S[Fe]4S[Mo]5S[Fe][C]234([Fe]1)[Fe]S5 |
SMILES | OpenEye OEToolkits | 2.0.7 | C12345[Fe]6[S]7[Fe]1[S]8[Fe]7[S]6[Fe]28S[Fe]39[S]1[Fe]4[S]2[Fe]5[S]9[Mo]21 |
Canonical SMILES | CACTVS | 3.385 | S1[Fe]S[Fe]2S[Fe]3S[Fe]4S[Mo]5S[Fe][C]234([Fe]1)[Fe]S5 |
Canonical SMILES | OpenEye OEToolkits | 2.0.7 | C12345[Fe]6[S]7[Fe]1[S]8[Fe]7[S]6[Fe]28S[Fe]39[S]1[Fe]4[S]2[Fe]5[S]9[Mo]21 |
InChI | InChI | 1.03 | InChI=1S/C.7Fe.Mo.7S |
InChIKey | InChI | 1.03 | BCCRTSRPWONJBV-UHFFFAOYSA-N |