Marvin  10021310382D          

  8 12  0  0  0  0            999 V2000
   17.4983  -18.5046    0.0000 S   0  3  0  0  0  0  0  0  0  0  0  0
   23.5129  -24.5192    0.0000 S   0  3  0  0  0  0  0  0  0  0  0  0
   23.5129  -18.5046    0.0000 Fe  0  5  0  0  0  0  0  0  0  0  0  0
   17.4989  -24.5192    0.0000 Fe  0  5  0  0  0  0  0  0  0  0  0  0
   20.5418  -15.8959    0.0000 Fe  0  5  0  0  0  0  0  0  0  0  0  0
   26.5564  -21.9104    0.0000 Fe  0  5  0  0  0  0  0  0  0  0  0  0
   26.5564  -15.8959    0.0000 S   0  3  0  0  0  0  0  0  0  0  0  0
   20.5424  -21.9104    0.0000 S   0  3  0  0  0  0  0  0  0  0  0  0
  3  1  1  0  0  0  0
  4  1  1  0  0  0  0
  4  2  1  0  0  0  0
  3  2  1  0  0  0  0
  7  5  1  0  0  0  0
  8  5  1  0  0  0  0
  8  6  1  0  0  0  0
  7  6  1  0  0  0  0
  1  5  1  0  0  0  0
  3  7  1  0  0  0  0
  2  6  1  0  0  0  0
  8  4  1  0  0  0  0
M  CHG  8   1   1   2   1   3  -1   4  -1   5  -1   6  -1   7   1   8   1
M  END
> <ID>
CHEBI:49883

> <NAME>
tetra-mu3-sulfido-tetrairon

> <DEFINITION>
An Fe4S4 iron-sulfur cluster in which each sulfur is attached to three of the iron atoms.

> <STAR>
3

> <SECONDARY_ID>
CHEBI:49880; CHEBI:21139

> <SYNONYM>
IRON/SULFUR CLUSTER; [Fe4S4] cluster; [Fe4S4]; [4Fe-4S] cluster; [4Fe-4S] cluster

> <IUPAC_NAME>
tetra-mu3-sulfido-tetrairon

> <FORMULA>
Fe4S4

> <MASS>
351.64000

> <MONOISOTOPIC_MASS>
351.62803

> <CHARGE>
0

> <SMILES>
[S+]12[Fe-]3[S+]4[Fe-]1[S+]1[Fe-]2[S+]3[Fe-]41

> <INCHI>
InChI=1S/4Fe.4S/q4*-1;4*+1

> <INCHIKEY>
VGDWTWWMYPIWQM-UHFFFAOYSA-N

> <REAXYS_REGISTRY_NUMBER>
16254399

> <PDBECHEM_ACCESSION>
SF4

$$$$