Information card for entry 4105304

Structure parameters

• Formula: C54 H60 In3 N3 O33
• Calculated formula: C54 In3 N3 O33
• Title of publication: Multiroute Synthesis of Porous Anionic Frameworks and Size-Tunable Extraframework Organic Cation-Controlled Gas Sorption Properties
• Authors of publication: Shumei Chen; Jian Zhang; Tao Wu; Pingyun Feng; Xianhui Bu
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2009
• Journal volume: 131
• Pages of publication: 16027 - 16029
• a: 20.4639 ± 0.0001 Å
• b: 20.4639 ± 0.0001 Å
• c: 20.4639 ± 0.0001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 8569.69 ± 0.07 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 220
• Hermann-Mauguin space group symbol: I -4 3 d
• Hall space group symbol: I -4bd 2c 3
• Residual factor for all reflections: 0.0716
• Residual factor for significantly intense reflections: 0.059
• Weighted residual factors for significantly intense reflections: 0.1676
• Weighted residual factors for all reflections included in the refinement: 0.173
• Goodness-of-fit parameter for all reflections included in the refinement: 1.113
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No