decacalcium dichloride hexaphosphate

Systemtic Name: decacalcium dichloride hexaphosphate Openeye Name: decacalcium dichloride hexaphosphate CAS Name: decacalcium dichloride hexaphosphate IUPAC Name: decacalcium dichloride hexaphosphate Traditional Name: decacalcium dichloride hexaphosphate Formula: Ca10Cl2O24P6 MolecularWeight: 1041.514166

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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-].[Cl-].[Cl-].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[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-].[Cl-].[Cl-].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2]

InChI

InChI=1S/10Ca.2ClH.6H3O4P/c;;;;;;;;;;;;6*1-5(2,3)4/h;;;;;;;;;;2*1H;6*(H3,1,2,3,4)/q10*+2;;;;;;;;/p-20