CUV
Summary
Name: | Fe(4)-Ni(1)-S(4) cluster, oxidized |
Synonyms: | C cluster, oxidized |
Formula: | Fe4 Ni S4 |
Formal charge: | 0 |
Formula weight: | 410.333 Da |
Component type: | NON-POLYMER |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.6 | 1$l^{3},3,5-trithia-2$l^{3},4$l^{3},6$l^{2}-triferrabicyclo[2.2.0]hexan-2-ylsulfanyl(nickelio)iron |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/4Fe.Ni.4S |
InChIKey | InChI | 1.03 | QGLWBXDZIHZONR-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | [Ni].[Fe]S[Fe]1S[Fe]S[Fe]S1 |
SMILES | CACTVS | 3.385 | [Ni].[Fe]S[Fe]1S[Fe]S[Fe]S1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.6 | S1[Fe][S]2[Fe]1S[Fe]2S[Fe][Ni] |
SMILES | OpenEye OEToolkits | 2.0.6 | S1[Fe][S]2[Fe]1S[Fe]2S[Fe][Ni] |