T2N
Summary
Name: | 3,5-dioxa-7-thia-1-thionia-2$l^{2},4$l^{2},6$l^{3},8$l^{2}-tetraferrabicyclo[4.2.0]octane |
Formula: | Fe4 O2 S2 |
Formal charge: | 1 |
Formula weight: | 319.509 Da |
Component type: | non-polymer |
Chemical Identifiers
Program | Version | Name |
OpenEye OEToolkits | 2.0.7 | 3,5-dioxa-7-thia-1-thionia-2$l^{2},4$l^{2},6$l^{3},8$l^{2}-tetraferrabicyclo[4.2.0]octane |
Chemical Descriptors
Type | Program | Version | Descriptor |
InChI | InChI | 1.03 | InChI=1S/4Fe.2O.2S/q;;;;;;;+1 |
InChIKey | InChI | 1.03 | ZZXANUDJVNRRAL-UHFFFAOYSA-N |
SMILES_CANONICAL | CACTVS | 3.385 | O1[Fe]O[Fe]2S[Fe][S@+]2[Fe]1 |
SMILES | CACTVS | 3.385 | O1[Fe]O[Fe]2S[Fe][S+]2[Fe]1 |
SMILES_CANONICAL | OpenEye OEToolkits | 2.0.7 | O1[Fe]O[Fe]2S[Fe][S+]2[Fe]1 |
SMILES | OpenEye OEToolkits | 2.0.7 | O1[Fe]O[Fe]2S[Fe][S+]2[Fe]1 |