Information card for entry 7119731

Structure parameters

• Formula: C39 H22 Er3 O19
• Calculated formula: C39 H18 Er3 O19
• Title of publication: Robust high-connected rare-earth MOFs as efficient heterogeneous catalysts for CO2 conversion.
• Authors of publication: Wei, Na; Zuo, Rong-Xia; Zhang, Yu-Yang; Han, Zheng-Bo; Gu, Xue-Jun
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2017
• Journal volume: 53
• Journal issue: 22
• Pages of publication: 3224 - 3227
• a: 10.3534 ± 0.0003 Å
• b: 10.3534 ± 0.0003 Å
• c: 24.6485 ± 0.0007 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 2288.16 ± 0.11 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 176
• Hermann-Mauguin space group symbol: P 63/m
• Hall space group symbol: -P 6c
• Residual factor for all reflections: 0.1149
• Residual factor for significantly intense reflections: 0.1129
• Weighted residual factors for significantly intense reflections: 0.2642
• Weighted residual factors for all reflections included in the refinement: 0.2653
• Goodness-of-fit parameter for all reflections included in the refinement: 1.129
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No