| Molecular Formula |
C6H12FeN3O12 |
| Canonical SMILES |
C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[NH4+].[NH4+].[NH4+].[Fe+3] |
| Isomeric SMILES |
C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].C(=O)(C(=O)[O-])[O-].[NH4+].[NH4+].[NH4+].[Fe+3] |
| Molecular Weight |
374.0200 |
| InChIKey |
UEUDBBQFZIMOQJ-UHFFFAOYSA-K |
| InChI |
InChI=1S/3C2H2O4.Fe.3H3N/c3*3-1(4)2(5)6;;;;/h3*(H,3,4)(H,5,6);;3*1H3/q;;;+3;;;/p-3 |
| XLogP |
0.0000 |
| ExactMass |
373.9770 |
| MonoisotopicMass |
373.9770 |
| TPSA |
244.0000 |
| Complexity |
60.0000 |
| Charge |
0.0000 |
| HBondDonorCount |
3 |
| HBondAcceptorCount |
12 |
| RotatableBondCount |
0 |
| HeavyAtomCount |
22 |
| IsotopeAtomCount |
0 |
| AtomStereoCount |
0 |
| DefinedAtomStereoCount |
0 |
| UndefinedAtomStereoCount |
0 |
| BondStereoCount |
0 |
| DefinedBondStereoCount |
0 |
| UndefinedBondStereoCount |
0 |
| CovalentUnitCount |
7 |
| PatentCount |
992 |
| PatentFamilyCount |
622 |
| LiteratureCount |
25 |
