dicalcium phosphonato phosphate dihydrate

Systemtic Name: dicalcium phosphonato phosphate dihydrate Openeye Name: dicalcium phosphonato phosphate dihydrate CAS Name: dicalcium phosphonato phosphate dihydrate IUPAC Name: dicalcium phosphonato phosphate dihydrate Traditional Name: dicalcium phosphonato phosphate dihydrate Formula: Ca2H4O9P2 MolecularWeight: 290.129882

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

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

Isomeric SMILES

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

InChI

InChI=1S/2Ca.H4O7P2.2H2O/c;;1-8(2,3)7-9(4,5)6;;/h;;(H2,1,2,3)(H2,4,5,6);2*1H2/q2*+2;;;/p-4