Information card for entry 7130186

Structure parameters

• Formula: C39 H68 Al K N2 O Si2
• Calculated formula: C39 H68 Al K N2 O Si2
• Title of publication: Diverse reactivity of an Al(I)-centred anion towards ketones.
• Authors of publication: Liu, Han-Ying; Hill, Michael S.; Mahon, Mary F.
• Journal of publication: Chemical communications (Cambridge, England)
• Year of publication: 2022
• a: 44.6873 ± 0.001 Å
• b: 12.4327 ± 0.0001 Å
• c: 37.5655 ± 0.0008 Å
• α: 90°
• β: 127.202 ± 0.003°
• γ: 90°
• Cell volume: 16623.8 ± 0.8 ų
• Cell temperature: 150 ± 0.1 K
• Ambient diffraction temperature: 150 ± 0.1 K
• Number of distinct elements: 7
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0512
• Residual factor for significantly intense reflections: 0.0414
• Weighted residual factors for significantly intense reflections: 0.1008
• Weighted residual factors for all reflections included in the refinement: 0.1066
• Goodness-of-fit parameter for all reflections included in the refinement: 1.019
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No