Information card for entry 4122023

Structure parameters

• Formula: C72 H100 Al2 N6 O0.5
• Calculated formula: C72 H98 Al2 N6 O0.5
• Title of publication: Oxidative Addition of σ Bonds to an Al(I) Center.
• Authors of publication: Chu, Terry; Korobkov, Ilia; Nikonov, Georgii I.
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2014
• Journal volume: 136
• Journal issue: 25
• Pages of publication: 9195 - 9202
• a: 11.9759 ± 0.0009 Å
• b: 12.3948 ± 0.0008 Å
• c: 24.9637 ± 0.0017 Å
• α: 104.188 ± 0.003°
• β: 93.639 ± 0.004°
• γ: 90.242 ± 0.004°
• Cell volume: 3584.6 ± 0.4 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1329
• Residual factor for significantly intense reflections: 0.0689
• Weighted residual factors for significantly intense reflections: 0.1628
• Weighted residual factors for all reflections included in the refinement: 0.1955
• Goodness-of-fit parameter for all reflections included in the refinement: 1.011
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No