Information card for entry 2233765

Structure parameters

• Chemical name: Poly[[pentaaqua(μ~4~-pyridine-2,4,6-tricarboxylato)(μ~3~-pyridine-2,4,6- tricarboxylato)disamarium(III)] monohydrate]
• Formula: C16 H16 N2 O18 Sm2
• Calculated formula: C16 H16 N2 O18 Sm2
• Title of publication: Poly[[pentaaqua(μ~4~-pyridine-2,4,6-tricarboxylato)(μ~3~-pyridine-2,4,6-tricarboxylato)disamarium(III)] monohydrate]
• Authors of publication: Jin, Yong-Wei; Zhu, Hong-lin
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 3
• Pages of publication: m287
• a: 18.426 ± 0.004 Å
• b: 6.9082 ± 0.0014 Å
• c: 18.583 ± 0.004 Å
• α: 90°
• β: 111.98 ± 0.03°
• γ: 90°
• Cell volume: 2193.5 ± 0.9 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0202
• Residual factor for significantly intense reflections: 0.0183
• Weighted residual factors for significantly intense reflections: 0.0404
• Weighted residual factors for all reflections included in the refinement: 0.0408
• Goodness-of-fit parameter for all reflections included in the refinement: 1.188
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes