Information card for entry 4502256

Structure parameters

• Formula: C9 H18 N O13 Pr
• Calculated formula: C9 H18 N O13 Pr
• Title of publication: Formation of the Water Layer in Lanthanide Coordination Polymers with 6-Methyl-2,3,5-Pyridinetricarboxylate as a Novel Bridging Ligand
• Authors of publication: Yang, Ai-Hong; Zhao, Li-Hua; Quan, Ying-Ping; Gao, Hong-Ling; Cui, Jian-Zhong; Shi, Wei; Cheng, Peng
• Journal of publication: Crystal Growth & Design
• Year of publication: 2010
• Journal volume: 10
• Journal issue: 1
• Pages of publication: 218
• a: 12.173 ± 0.002 Å
• b: 7.3496 ± 0.0015 Å
• c: 18.45 ± 0.004 Å
• α: 90°
• β: 96.93 ± 0.03°
• γ: 90°
• Cell volume: 1638.6 ± 0.6 ų
• Cell temperature: 113 ± 2 K
• Ambient diffraction temperature: 113 ± 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: 0.0331
• Residual factor for significantly intense reflections: 0.0283
• Weighted residual factors for significantly intense reflections: 0.0743
• Weighted residual factors for all reflections included in the refinement: 0.0805
• Goodness-of-fit parameter for all reflections included in the refinement: 1.004
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No