Information card for entry 2222437

Structure parameters

• Chemical name: Poly[diaqua(μ~4~-3,5-dicarboxylatopyrazol-1-ido- κ^6^<i>N</i>^1^,<i>O</i>^5^:<i>N</i>^2^,<i>O</i>^3^:<i>O</i>^3'^: <i>O</i>^5^,<i>O</i>^5'^)lanthanum(III)]
• Formula: C5 H5 La N2 O6
• Calculated formula: C5 H5 La N2 O6
• Title of publication: Poly[diaqua(μ~4~-3,5-dicarboxylatopyrazol-1-ido-κ^6^<i>N</i>^1^,<i>O</i>^5^:<i>N</i>^2^,<i>O</i>^3^:<i>O</i>^3'^:<i>O</i>^5^,<i>O</i>^5'^)lanthanum(III)]
• Authors of publication: Xia, Jun; Wei, Jun-Fu
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 7
• Pages of publication: m732
• a: 12.5712 ± 0.0008 Å
• b: 8.435 ± 0.0006 Å
• c: 16.007 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1697.35 ± 0.19 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0194
• Residual factor for significantly intense reflections: 0.0162
• Weighted residual factors for significantly intense reflections: 0.0396
• Weighted residual factors for all reflections included in the refinement: 0.0406
• Goodness-of-fit parameter for all reflections included in the refinement: 1.059
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes