Information card for entry 1566764

Structure parameters

• Formula: C50 H90 Al K N4 O8 S Si2
• Calculated formula: C50 H90 Al K N4 O8 S Si2
• Title of publication: Carbon–chalcogen bond formation initiated by [Al(NONDipp)(E)]− anions containing Al–E{16} (E{16} = S, Se) multiple bonds
• Authors of publication: Evans, Matthew J.; Anker, Mathew D.; McMullin, Claire L.; Neale, Samuel E.; Rajabi, Nasir A.; Coles, Martyn P.
• Journal of publication: Chemical Science
• Year of publication: 2022
• a: 10.0626 ± 0.0004 Å
• b: 17.1004 ± 0.0006 Å
• c: 17.2361 ± 0.0006 Å
• α: 88.851 ± 0.003°
• β: 83.037 ± 0.003°
• γ: 84.293 ± 0.003°
• Cell volume: 2929.33 ± 0.19 ų
• Cell temperature: 149.95 ± 0.15 K
• Ambient diffraction temperature: 149.95 ± 0.15 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0876
• Residual factor for significantly intense reflections: 0.0612
• Weighted residual factors for significantly intense reflections: 0.1382
• Weighted residual factors for all reflections included in the refinement: 0.151
• Goodness-of-fit parameter for all reflections included in the refinement: 1.083
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No