Information card for entry 1569257

Structure parameters

• Formula: C36 H20 Bi4 O16.3
• Calculated formula: C36 H20 Bi4 O16.2938
• Title of publication: A conductive catecholate-based framework coordinated with unsaturated bismuth boosts CO₂ electroreduction to formate.
• Authors of publication: Gao, Zengqiang; Hou, Man; Shi, Yongxia; Li, Li; Sun, Qisheng; Yang, Shuyuan; Jiang, Zhiqiang; Yang, Wenjuan; Zhang, Zhicheng; Hu, Wenping
• Journal of publication: Chemical science
• Year of publication: 2023
• Journal volume: 14
• Journal issue: 25
• Pages of publication: 6860 - 6866
• a: 16.9776 ± 0.0017 Å
• b: 14.3793 ± 0.0004 Å
• c: 26.623 ± 0.003 Å
• α: 90°
• β: 143.57 ± 0.02°
• γ: 90°
• Cell volume: 3859.6 ± 1.9 ų
• Cell temperature: 159.99 ± 0.1 K
• Ambient diffraction temperature: 159.99 ± 0.1 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: 0.0664
• Residual factor for significantly intense reflections: 0.0612
• Weighted residual factors for significantly intense reflections: 0.1756
• Weighted residual factors for all reflections included in the refinement: 0.1804
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No