Information card for entry 7217598

Structure parameters

• Formula: C28 H16 In O8
• Calculated formula: C28 H16 In O8
• Title of publication: Sorption comparison of two indium‒organic framework isomers with syn‒anti configurations
• Authors of publication: Qian, Jinjie; Jiang, Feilong; Su, Kongzhao; Li, Qipeng; Zhou, Kang; Wu, Mingyan; Yuan, Daqiang; Hong, Maochun
• Journal of publication: CrystEngComm
• Year of publication: 2014
• Journal volume: 16
• Journal issue: 32
• Pages of publication: 7434
• a: 14.0612 ± 0.0002 Å
• b: 16.1146 ± 0.0002 Å
• c: 15.5087 ± 0.0002 Å
• α: 90°
• β: 103.837 ± 0.002°
• γ: 90°
• Cell volume: 3412.15 ± 0.08 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• 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: 0.0382
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for significantly intense reflections: 0.1226
• Weighted residual factors for all reflections included in the refinement: 0.1251
• Goodness-of-fit parameter for all reflections included in the refinement: 1.014
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Duplicate of: 7215834
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No