diphosphonatomethanol; iron(3+)

Systemtic Name: diphosphonatomethanol; iron(3+) Openeye Name: tetraferric diphosphonatomethanol CAS Name: diphosphonatomethanol; iron(3+) IUPAC Name: diphosphonatomethanol; iron(3+) Traditional Name: tetraferric diphosphonatomethanol Formula: C3H6Fe4O21P6 MolecularWeight: 787.289706

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Descriptors Computed from Structure

Canonical SMILES:

C(O)(P(=O)([O-])[O-])P(=O)([O-])[O-].C(O)(P(=O)([O-])[O-])P(=O)([O-])[O-].C(O)(P(=O)([O-])[O-])P(=O)([O-])[O-].[Fe+3].[Fe+3].[Fe+3].[Fe+3]

Isomeric SMILES

C(O)(P(=O)([O-])[O-])P(=O)([O-])[O-].C(O)(P(=O)([O-])[O-])P(=O)([O-])[O-].C(O)(P(=O)([O-])[O-])P(=O)([O-])[O-].[Fe+3].[Fe+3].[Fe+3].[Fe+3]

InChI

InChI=1S/3CH6O7P2.4Fe/c3*2-1(9(3,4)5)10(6,7)8;;;;/h3*1-2H,(H2,3,4,5)(H2,6,7,8);;;;/q;;;4*+3/p-12