Information card for entry 7127847

Structure parameters

• Formula: C60 H130 Al10 O40
• Calculated formula: C60 H130 Al10 O40
• Title of publication: Aluminium nanorings: configuration deformation and structural transformation.
• Authors of publication: Geng, Lin; Li, Qiao-Hong; Wang, San-Tai; Liu, Ya-Jie; Fang, Wei-Hui; Zhang, Jian
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2021
• Journal volume: 57
• Journal issue: 16
• Pages of publication: 2085 - 2088
• a: 9.1044 ± 0.0002 Å
• b: 15.8179 ± 0.0002 Å
• c: 28.5609 ± 0.0003 Å
• α: 90°
• β: 91.622 ± 0.001°
• γ: 90°
• Cell volume: 4111.48 ± 0.11 ų
• Cell temperature: 100.6 ± 0.8 K
• Ambient diffraction temperature: 100.6 ± 0.8 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: 0.0843
• Residual factor for significantly intense reflections: 0.0652
• Weighted residual factors for significantly intense reflections: 0.1787
• Weighted residual factors for all reflections included in the refinement: 0.1945
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.3405 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No