Information card for entry 4348213

Structure parameters

• Formula: C8.5 H In0.5 N0 O4.5
• Calculated formula: C8.936 H In0.5 O4.064
• Title of publication: Four-connected metal‒organic frameworks constructed by tetracarboxylate acid-based ligands
• Authors of publication: Sun, Libo; Pan, Qinhe; Liang, Zhiqiang; Yu, Jihong
• Journal of publication: Inorganic Chemistry Frontiers
• Year of publication: 2014
• Journal volume: 1
• Journal issue: 6
• Pages of publication: 478
• a: 18.057 ± 0.0003 Å
• b: 18.057 ± 0.0003 Å
• c: 13.4495 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4385.28 ± 0.19 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 92
• Hermann-Mauguin space group symbol: P 41 21 2
• Hall space group symbol: P 4abw 2nw
• Residual factor for all reflections: 0.0344
• Residual factor for significantly intense reflections: 0.0276
• Weighted residual factors for significantly intense reflections: 0.052
• Weighted residual factors for all reflections included in the refinement: 0.053
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No