Information card for entry 2210338

Structure parameters

• Common name: Dirubidium terephthalate dihydrate
• Chemical name: Poly[di-μ~3~-aqua-μ~4~-terephthalato-dirubidium]
• Formula: C8 H8 O6 Rb2
• Calculated formula: C8 H8 O6 Rb2
• SMILES: C(=O)(c1ccc(C(=O)[O-])cc1)[O-].[Rb+].O.O.[Rb+]
• Title of publication: Poly[di-μ~3~-aqua-μ~4~-terephthalato-dirubidium]
• Authors of publication: Stein, Irena; Ruschewitz, Uwe
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 9
• Pages of publication: m2116 - m2118
• a: 12.663 ± 0.003 Å
• b: 3.9531 ± 0.0005 Å
• c: 11.873 ± 0.003 Å
• α: 90°
• β: 111.87 ± 0.03°
• γ: 90°
• Cell volume: 551.6 ± 0.2 ų
• Cell temperature: 295 ± 2 K
• Ambient diffraction temperature: 295 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0669
• Residual factor for significantly intense reflections: 0.042
• Weighted residual factors for significantly intense reflections: 0.092
• Weighted residual factors for all reflections included in the refinement: 0.1032
• Goodness-of-fit parameter for all reflections included in the refinement: 0.958
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes