Information card for entry 7237244

Structure parameters

• Formula: C60 H64 Al2 Mg O11
• Calculated formula: C60 H64 Al2 Mg O11
• Title of publication: A general synthetic methodology to access magnesium aluminate electrolyte systems for Mg batteries
• Authors of publication: Keyzer, Evan N.; Lee, Jeongjae; Liu, Zigeng; Bond, Andrew D.; Wright, Dominic S.; Grey, Clare P.
• Journal of publication: Journal of Materials Chemistry A
• Year of publication: 2019
• Journal volume: 7
• Journal issue: 6
• Pages of publication: 2677
• a: 14.1081 ± 0.0004 Å
• b: 21.3826 ± 0.0006 Å
• c: 8.9782 ± 0.0003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2708.43 ± 0.14 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 5
• Space group number: 18
• Hermann-Mauguin space group symbol: P 21 21 2
• Hall space group symbol: P 2 2ab
• Residual factor for all reflections: 0.0711
• Residual factor for significantly intense reflections: 0.0487
• Weighted residual factors for significantly intense reflections: 0.0987
• Weighted residual factors for all reflections included in the refinement: 0.1093
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No