Information card for entry 4122027

Structure parameters

• Formula: C39 H57 Al N2
• Calculated formula: C39 H58 Al N2
• 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: 16.3923 ± 0.0004 Å
• b: 19.852 ± 0.0006 Å
• c: 21.4153 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6969 ± 0.3 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 4
• Space group number: 72
• Hermann-Mauguin space group symbol: I b a m
• Hall space group symbol: -I 2 2c
• Residual factor for all reflections: 0.0652
• Residual factor for significantly intense reflections: 0.0453
• Weighted residual factors for significantly intense reflections: 0.1171
• Weighted residual factors for all reflections included in the refinement: 0.1336
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No