Information card for entry 1572826

Structure parameters

• Formula: C31.5 H23.5 B Er1.5 N O10.5
• Calculated formula: C31.5 H23.5 B Er1.5 N O10.5
• Title of publication: A tetraphenylborate-based anionic metal–organic framework as a versatile solid electrolyte for fast Li+, Na+, K+, Mg2+, Ca2+, and Zn2+ transportation
• Authors of publication: Xia, Qingchun; Han, Kaixin; Ma, Xuxiao; Qiu, Pengtao; Li, Zhiyong; Chen, Xuenian
• Journal of publication: Chemical Science
• Year of publication: 2024
• a: 32.6786 ± 0.0005 Å
• b: 24.8964 ± 0.0004 Å
• c: 13.9814 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 11375 ± 0.4 ų
• Cell temperature: 170 ± 0.1 K
• Ambient diffraction temperature: 170 ± 0.1 K
• Number of distinct elements: 6
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0687
• Residual factor for significantly intense reflections: 0.0537
• Weighted residual factors for significantly intense reflections: 0.1479
• Weighted residual factors for all reflections included in the refinement: 0.1537
• Goodness-of-fit parameter for all reflections included in the refinement: 1.141
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No