tetracalcium carbonate diphosphate

Systemtic Name: tetracalcium carbonate diphosphate Openeye Name: tetracalcium carbonate diphosphate CAS Name: tetracalcium carbonate diphosphate IUPAC Name: tetracalcium carbonate diphosphate Traditional Name: tetracalcium carbonate diphosphate Formula: CCa4O11P2 MolecularWeight: 410.263622

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/CH2O3.4Ca.2H3O4P/c2-1(3)4;;;;;2*1-5(2,3)4/h(H2,2,3,4);;;;;2*(H3,1,2,3,4)/q;4*+2;;/p-8