decacalcium fluoride hydroxide hexaphosphate

Systemtic Name: decacalcium fluoride hydroxide hexaphosphate Openeye Name: decacalcium fluoride hydroxide hexaphosphate CAS Name: decacalcium fluoride hydroxide hexaphosphate IUPAC Name: decacalcium fluoride hydroxide hexaphosphate Traditional Name: decacalcium fluoride hydroxide hexaphosphate Formula: Ca10FHO25P6 MolecularWeight: 1006.613909

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Descriptors Computed from Structure

Canonical SMILES:

[OH-].[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-].[F-].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2]

Isomeric SMILES

[OH-].[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-].[F-].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2].[Ca+2]

InChI

InChI=1S/10Ca.FH.6H3O4P.H2O/c;;;;;;;;;;;6*1-5(2,3)4;/h;;;;;;;;;;1H;6*(H3,1,2,3,4);1H2/q10*+2;;;;;;;;/p-20