Information card for entry 1007209

Structure parameters

• Chemical name: Octasodium cyclo-octaphosphate hexahydrate
• Formula: H12 Na8 O30 P8
• Calculated formula: H12 Na8 O30 P8
• SMILES: O.[Na+].[Na+].[Na+].O.P1(=O)([O-])OP(=O)(OP(=O)(OP(=O)([O-])OP(=O)([O-])OP(=O)(OP(=O)(OP(=O)([O-])O1)[O-])[O-])[O-])[O-].[Na+].[Na+].[Na+].O.O.O.O.[Na+].[Na+]
• Title of publication: Crystal structure of sodium cyclooctaphosphate hexahydrate, Na~8~P~8~O~24~ . 6H~2~O
• Authors of publication: Schuelke, U; Averbuch-Pouchot, M T; Durif, A
• Journal of publication: Journal of Solid State Chemistry
• Year of publication: 1992
• Journal volume: 98
• Pages of publication: 213 - 218
• a: 6.622 ± 0.002 Å
• b: 10.031 ± 0.004 Å
• c: 11.25 ± 0.004 Å
• α: 104.06 ± 0.05°
• β: 101.21 ± 0.05°
• γ: 90.88 ± 0.05°
• Cell volume: 709.5 ų
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.036
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No