Information card for entry 4509478

Structure parameters

• Formula: C28 H12 Ba3 N4 O22 Sm2
• Calculated formula: C28 H8 Ba3 N4 O22 Sm2
• Title of publication: Fabrication and Properties of Eight Novel Lanthanide−Organic Frameworks Based on 4-Hydroxypyran-2,6-dicarboxylate and 4-Hydroxypyridine-2,6-dicarboxylate
• Authors of publication: Fang, Ming; Chang, Lixian; Liu, Xuhui; Zhao, Bin; Zuo, Ya; Chen, Zhi
• Journal of publication: Crystal Growth & Design
• Year of publication: 2009
• Journal volume: 9
• Journal issue: 9
• Pages of publication: 4006
• a: 15.254 ± 0.003 Å
• b: 15.472 ± 0.003 Å
• c: 15.524 ± 0.003 Å
• α: 90°
• β: 119.36 ± 0.03°
• γ: 90°
• Cell volume: 3193.2 ± 1.4 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 2 K
• Number of distinct elements: 6
• 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: 0.0403
• Residual factor for significantly intense reflections: 0.0321
• Weighted residual factors for significantly intense reflections: 0.062
• Weighted residual factors for all reflections included in the refinement: 0.0656
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No