Information card for entry 7219937

Structure parameters

• Formula: C22 H15 In N3 O9
• Calculated formula: C16 H6 In O9
• Title of publication: Syntheses, topological structures and properties of six metal‒organic frameworks constructed from a flexible tetracarboxylate ligand
• Authors of publication: Peng, Yu; Li, Guanghua; Hua, Jia; Shi, Zhan; Feng, Shouhua
• Journal of publication: CrystEngComm
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 16
• Pages of publication: 3162
• a: 17.303 ± 0.004 Å
• b: 9.925 ± 0.002 Å
• c: 22.41 ± 0.005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3848.5 ± 1.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0848
• Residual factor for significantly intense reflections: 0.07
• Weighted residual factors for significantly intense reflections: 0.2562
• Weighted residual factors for all reflections included in the refinement: 0.2692
• Goodness-of-fit parameter for all reflections included in the refinement: 1.132
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No