Information card for entry 2238830

Structure parameters

• Chemical name: <i>catena</i>-Poly[[diaqua[μ~2~-4-(4-carboxyphenoxy)benzoato](μ~2~-4,4'-oxydibenzoato)praseodymium(III)] monohydrate]
• Formula: C28 H23 O13 Pr
• Calculated formula: C28 H23 O13 Pr
• Title of publication: <i>catena</i>-Poly[[diaqua[μ~2~-4-(4-carboxyphenoxy)benzoato](μ~2~-4,4'-oxydibenzoato)praseodymium(III)] monohydrate]
• Authors of publication: Li, Ping; Su, Duo-Meng; Zheng, Chang-Ge
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 11
• Pages of publication: m586 - m587
• a: 27.397 ± 0.0017 Å
• b: 9.5764 ± 0.0006 Å
• c: 21.6754 ± 0.0014 Å
• α: 90°
• β: 97.433 ± 0.001°
• γ: 90°
• Cell volume: 5639.1 ± 0.6 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0274
• Residual factor for significantly intense reflections: 0.0245
• Weighted residual factors for significantly intense reflections: 0.0565
• Weighted residual factors for all reflections included in the refinement: 0.0588
• Goodness-of-fit parameter for all reflections included in the refinement: 1.08
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No