Information card for entry 1566766

Structure parameters

• Formula: C74 H132 Al2 K2 N4 O10 S2 Si4
• Calculated formula: C74 H132 Al2 K2 N4 O10 S2 Si4
• 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: 12.27766 ± 0.00009 Å
• b: 24.87997 ± 0.00017 Å
• c: 14.9006 ± 0.00011 Å
• α: 90°
• β: 94.3187 ± 0.0006°
• γ: 90°
• Cell volume: 4538.73 ± 0.06 ų
• Cell temperature: 150.01 ± 0.1 K
• Ambient diffraction temperature: 150.01 ± 0.1 K
• Number of distinct elements: 8
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0365
• Residual factor for significantly intense reflections: 0.0356
• Weighted residual factors for significantly intense reflections: 0.0955
• Weighted residual factors for all reflections included in the refinement: 0.0965
• Goodness-of-fit parameter for all reflections included in the refinement: 1.022
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No