Information card for entry 4518484

Structure parameters

• Formula: C26 H45 N8 O30 Zn3.5
• Calculated formula: C26 H45 N8 O30 Zn3.5
• Title of publication: A High-Performance Zinc-Organic Framework with Accessible Open Metal Sites Catalyzes CO2 and Styrene Oxide into Styrene Carbonate under Mild Conditions
• Authors of publication: Li, Yixing; Zhang, Xiao; Lan, Jianwen; Li, Dazhi; Wang, Zhijiang; Xu, Ping; Sun, Jianmin
• Journal of publication: ACS Sustainable Chemistry & Engineering
• Year of publication: 2021
• Journal volume: 9
• Journal issue: 7
• Pages of publication: 2795 - 2803
• a: 7.272 ± 0.002 Å
• b: 11.453 ± 0.004 Å
• c: 12.792 ± 0.004 Å
• α: 105.317 ± 0.011°
• β: 97.72 ± 0.011°
• γ: 94.62 ± 0.01°
• Cell volume: 1010.7 ± 0.6 ų
• Cell temperature: 304 ± 2 K
• Ambient diffraction temperature: 304 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0636
• Residual factor for significantly intense reflections: 0.0625
• Weighted residual factors for significantly intense reflections: 0.1759
• Weighted residual factors for all reflections included in the refinement: 0.1765
• Goodness-of-fit parameter for all reflections included in the refinement: 1.068
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No