tricalcium phosphono dihydrogen phosphate diphosphate

Systemtic Name: tricalcium phosphono dihydrogen phosphate diphosphate Openeye Name: tricalcium phosphono dihydrogen phosphate diphosphate CAS Name: tricalcium phosphono dihydrogen phosphate diphosphate IUPAC Name: tricalcium phosphono dihydrogen phosphate diphosphate Traditional Name: tricalcium phosphono dihydrogen phosphate diphosphate Formula: Ca3H4O15P4 MolecularWeight: 488.151804

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Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/3Ca.H4O7P2.2H3O4P/c;;;1-8(2,3)7-9(4,5)6;2*1-5(2,3)4/h;;;(H2,1,2,3)(H2,4,5,6);2*(H3,1,2,3,4)/q3*+2;;;/p-6