Information card for entry 4103729

Structure parameters

• Formula: C46 H56 In4 K3 N26 O27.5
• Calculated formula: C46 H56 In4 K3 N25.9867 O27.49
• Title of publication: From Metal-Organic Squares to Porous Zeolite-like Supramolecular Assemblies
• Authors of publication: Shuang Wang; Tingting Zhao; Guanghua Li; Lukasz Wojtas; Qisheng Huo; Mohamed Eddaoudi; Yunling Liu
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2010
• Journal volume: 132
• Pages of publication: 18038 - 18041
• a: 29.319 ± 0.003 Å
• b: 29.319 ± 0.003 Å
• c: 29.319 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 25203 ± 4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 204
• Hermann-Mauguin space group symbol: I m -3
• Hall space group symbol: -I 2 2 3
• Residual factor for all reflections: 0.0737
• Residual factor for significantly intense reflections: 0.0497
• Weighted residual factors for significantly intense reflections: 0.1343
• Weighted residual factors for all reflections included in the refinement: 0.1464
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No