Marvin  01230621322D          

  7  9  0  0  0  0            999 V2000
    0.4125    0.4125    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.4125   -0.4125    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
    0.4125   -0.4125    0.0000 Fe  0  0  0  0  0  0  0  0  0  0  0  0
   -0.4125    0.4125    0.0000 Fe  0  0  0  0  0  0  0  0  0  0  0  0
   -0.8690   -0.8690    0.0000 Fe  0  0  0  0  0  0  0  0  0  0  0  0
   -0.8690   -0.0440    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
   -0.0440   -0.8690    0.0000 S   0  0  0  0  0  0  0  0  0  0  0  0
  3  2  1  0  0  0  0
  3  1  1  0  0  0  0
  2  4  1  0  0  0  0
  1  4  1  0  0  0  0
  2  5  1  0  0  0  0
  3  7  1  0  0  0  0
  4  6  1  0  0  0  0
  6  5  1  0  0  0  0
  5  7  1  0  0  0  0
M  END
> <ID>
CHEBI:47402

> <NAME>
tri-mu-sulfido-mu3-sulfido-triiron(0)

> <STAR>
3

> <SECONDARY_ID>
CHEBI:47401; CHEBI:33750

> <SYNONYM>
[Fe3S4](0); [3Fe-4S](0) cluster; [3Fe-4S](0)

> <IUPAC_NAME>
tri-mu-sulfido-mu3-sulfido-triiron(0)

> <FORMULA>
Fe3S4

> <MASS>
295.79900

> <MONOISOTOPIC_MASS>
295.69309

> <CHARGE>
0

> <SMILES>
S1[Fe]2S[Fe]3S[Fe]1[S]23

> <INCHI>
InChI=1S/3Fe.4S

> <INCHIKEY>
FCXHZBQOKRZXKS-UHFFFAOYSA-N

$$$$