tetracalcium octaphosphate

Systemtic Name: tetracalcium octaphosphate Openeye Name: tetracalcium octaphosphate CAS Name: tetracalcium octaphosphate IUPAC Name: tetracalcium octaphosphate Traditional Name: tetracalcium octaphosphate Formula: Ca4O32P8-16 MolecularWeight: 920.082888

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Descriptors Computed from Structure

Canonical SMILES:

[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[Ca+2].[Ca+2].[Ca+2].[Ca+2]

Isomeric SMILES

[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[O-]P(=O)([O-])[O-].[Ca+2].[Ca+2].[Ca+2].[Ca+2]

InChI

InChI=1S/4Ca.8H3O4P/c;;;;8*1-5(2,3)4/h;;;;8*(H3,1,2,3,4)/q4*+2;;;;;;;;/p-24