Information card for entry 2208415

Structure parameters

• Chemical name: poly[[aqua(μ~4~-1,4-cyclohexanedicarboxylato)praseodymium(III)] hemihydrate]
• Formula: C12 H18 O7.5 Pr
• Calculated formula: C12 H15 O7.5 Pr
• Title of publication: Poly[[aqua(μ~4~-1,4-cyclohexanedicarboxylato)praseodymium(III)] hemihydrate]
• Authors of publication: Guang-Bo Che; Chun-Bo Liu; Hong Liu; Bo Liu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 3
• Pages of publication: m480 - m482
• a: 7.9451 ± 0.0016 Å
• b: 9.0421 ± 0.0018 Å
• c: 10.538 ± 0.002 Å
• α: 72.22 ± 0.03°
• β: 84.09 ± 0.03°
• γ: 84.01 ± 0.03°
• Cell volume: 714.9 ± 0.3 ų
• Cell temperature: 292 ± 2 K
• Ambient diffraction temperature: 292 ± 2 K
• 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: 0.048
• Residual factor for significantly intense reflections: 0.0356
• Weighted residual factors for significantly intense reflections: 0.0811
• Weighted residual factors for all reflections included in the refinement: 0.0851
• Goodness-of-fit parameter for all reflections included in the refinement: 1.114
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes