Information card for entry 4517301

Structure parameters

• Formula: C24 H12 Cu2 O10 Se
• Calculated formula: C24 H12 Cu2 O10 Se
• Title of publication: Accelerated C₂H₂/CO₂ Separation by a Se-Functionalized Porous Coordination Polymer with Low Binding Energy.
• Authors of publication: Dong, Qiubing; Guo, Yanan; Cao, Haifei; Wang, Suna; Matsuda, Ryotaro; Duan, Jingui
• Journal of publication: ACS applied materials & interfaces
• Year of publication: 2020
• Journal volume: 12
• Journal issue: 3
• Pages of publication: 3764 - 3772
• a: 18.756 ± 0.002 Å
• b: 18.756 ± 0.002 Å
• c: 37.339 ± 0.01 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 11376 ± 3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 166
• Hermann-Mauguin space group symbol: R -3 m :H
• Hall space group symbol: -R 3 2"
• Residual factor for all reflections: 0.0989
• Residual factor for significantly intense reflections: 0.0792
• Weighted residual factors for significantly intense reflections: 0.2637
• Weighted residual factors for all reflections included in the refinement: 0.289
• Goodness-of-fit parameter for all reflections included in the refinement: 1.149
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No