Information card for entry 1577203

Structure parameters

• Chemical name: [{N(Dipp)}2(CMe)2CH]Al[CP(CH2)2(CMe)2](OSiiPr3)
• Formula: C45 H72 Al N2 O P Si
• Calculated formula: C45 H72 Al N2 O P Si
• Title of publication: Cyaphide Generation at an Aluminium(I) Center: A Useful Precursor for Phosphorus-Containing Heterocycles
• Authors of publication: Yakubenko, Artyom; García-Romero, Álvaro; Urwin, Stephanie; Fernandez, Israel; Goicoechea, Jose M.
• Journal of publication: Chemical Science
• Year of publication: 2026
• a: 12.3931 ± 0.0003 Å
• b: 17.6838 ± 0.0005 Å
• c: 20.4243 ± 0.0006 Å
• α: 90°
• β: 100.162 ± 0.001°
• γ: 90°
• Cell volume: 4405.9 ± 0.2 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0759
• Residual factor for significantly intense reflections: 0.0524
• Weighted residual factors for significantly intense reflections: 0.1492
• Weighted residual factors for all reflections included in the refinement: 0.1747
• Goodness-of-fit parameter for all reflections included in the refinement: 1.121
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No