Information card for entry 7109533

Structure parameters

• Formula: C66 H0 N0 O16 Yb3
• Calculated formula: C66 H36 O16 Yb3
• Title of publication: Low-energy regeneration and high productivity in a lanthanide-hexacarboxylate framework for high-pressure CO2-CH4-H2 separation
• Authors of publication: Yabing He; Hiroyasu Furukawa; Chuande Wu; Michael O'Keeffe; Rajamani Krishna; Banglin Chen
• Journal of publication: Chem.Commun.
• Year of publication: 2013
• Journal volume: 49
• Pages of publication: 6773
• a: 19.848 ± 0.0002 Å
• b: 19.848 ± 0.0002 Å
• c: 27.853 ± 0.0005 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 9502.5 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 190
• Hermann-Mauguin space group symbol: P -6 2 c
• Hall space group symbol: P -6c -2c
• Residual factor for all reflections: 0.0736
• Residual factor for significantly intense reflections: 0.0633
• Weighted residual factors for significantly intense reflections: 0.1943
• Weighted residual factors for all reflections included in the refinement: 0.2097
• Goodness-of-fit parameter for all reflections included in the refinement: 1.23
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No