Information card for entry 4126370

Structure parameters

• Formula: C20 H16 F6 N4 O6 S2 Si Zn
• Calculated formula: C20 H16 F6 N4 O6 S2 Si Zn
• Title of publication: Optimized Separation of Acetylene from Carbon Dioxide and Ethylene in a Microporous Material.
• Authors of publication: Lin, Rui-Biao; Li, Libo; Wu, Hui; Arman, Hadi; Li, Bin; Lin, Rong-Guang; Zhou, Wei; Chen, Banglin
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2017
• Journal volume: 139
• Journal issue: 23
• Pages of publication: 8022 - 8028
• a: 10.092 ± 0.004 Å
• b: 19.277 ± 0.008 Å
• c: 15.171 ± 0.006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2951 ± 2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 72
• Hermann-Mauguin space group symbol: I b a m
• Hall space group symbol: -I 2 2c
• Residual factor for all reflections: 0.0969
• Residual factor for significantly intense reflections: 0.0891
• Weighted residual factors for significantly intense reflections: 0.2062
• Weighted residual factors for all reflections included in the refinement: 0.2116
• Goodness-of-fit parameter for all reflections included in the refinement: 1.167
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No