Information card for entry 1007098

Structure parameters

• Chemical name: Disodium hydrogencyclo-triphosphate
• Formula: H Na2 O9 P3
• Calculated formula: H Na2 O9 P3
• SMILES: [O-]P1(=O)OP(=O)(OP(=O)(O1)O)[O-].[Na+].[Na+]
• Title of publication: Structure d'un Trimetaphosphate Acide de Sodium: Na~2~ H P~3~ O~9~
• Authors of publication: Averbuch-Pouchot, M T; Guitel, J C; Durif, A
• Journal of publication: Acta Crystallographica C (39,1983-)
• Year of publication: 1983
• Journal volume: 39
• Pages of publication: 809 - 810
• a: 7.788 ± 0.005 Å
• b: 7.809 ± 0.005 Å
• c: 7.129 ± 0.005 Å
• α: 116.69 ± 0.05°
• β: 103.41 ± 0.05°
• γ: 81.94 ± 0.05°
• Cell volume: 376.5 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: 0.034
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No