Information card for entry 1566893

Structure parameters

• Formula: C71 H83 Al2 N4
• Calculated formula: C71 H83 Al2 N4
• Title of publication: Generation of a transient base-stabilised arylalumylene for the facile deconstruction of aromatic molecules
• Authors of publication: Dhara, Debabrata; Jayaraman, Arumugam; Härterich, Marcel; Dewhurst, Rian; Braunschweig, Holger
• Journal of publication: Chemical Science
• Year of publication: 2022
• a: 13.438 ± 0.002 Å
• b: 15.123 ± 0.003 Å
• c: 15.478 ± 0.002 Å
• α: 75.326 ± 0.006°
• β: 80.106 ± 0.011°
• γ: 84.764 ± 0.007°
• Cell volume: 2993.9 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0423
• Residual factor for significantly intense reflections: 0.0399
• Weighted residual factors for significantly intense reflections: 0.112
• Weighted residual factors for all reflections included in the refinement: 0.1143
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No