Information card for entry 4086335

Structure parameters

• Formula: C34 H51.5 Al F N2
• Calculated formula: C34 H51.5 Al F N2
• Title of publication: Transition Metal-like Oxidative Addition of C‒F and C‒O Bonds to an Aluminum(I) Center
• Authors of publication: Chu, Terry; Boyko, Yaroslav; Korobkov, Ilia; Nikonov, Georgii I.
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 22
• Pages of publication: 5363
• a: 13.848 ± 0.0004 Å
• b: 14.7791 ± 0.0004 Å
• c: 16.4335 ± 0.0005 Å
• α: 90°
• β: 98.814 ± 0.0015°
• γ: 90°
• Cell volume: 3323.58 ± 0.17 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0781
• Residual factor for significantly intense reflections: 0.0494
• Weighted residual factors for significantly intense reflections: 0.1203
• Weighted residual factors for all reflections included in the refinement: 0.1374
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No