Information card for entry 7058216

Structure parameters

• Formula: C17 H20 Mn N3 O11
• Calculated formula: C17 H20 Mn N3 O11
• Title of publication: Water-assisted proton conductivity of two highly stable imidazole multi-carboxylate-based MOFs
• Authors of publication: Qin, Yin; Li, Yilin; Guo, Kaimeng; Tang, Huabiao; Hou, Lifen; Li, Gang
• Journal of publication: New Journal of Chemistry
• Year of publication: 2019
• Journal volume: 43
• Journal issue: 12
• Pages of publication: 4859
• a: 10.2225 ± 0.0003 Å
• b: 11.0737 ± 0.0003 Å
• c: 11.3556 ± 0.0002 Å
• α: 91.38 ± 0.002°
• β: 111.018 ± 0.002°
• γ: 117.458 ± 0.003°
• Cell volume: 1036.54 ± 0.06 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 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: 0.0503
• Residual factor for significantly intense reflections: 0.0448
• Weighted residual factors for significantly intense reflections: 0.1181
• Weighted residual factors for all reflections included in the refinement: 0.1244
• 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: No
• Has Fobs: No