Information card for entry 1574959

Structure parameters

• Formula: C62 H99 Al Cl Cu N5 P Si
• Calculated formula: C62 H99 Al Cl Cu N5 P Si
• Title of publication: Aluminacyclopropene-phosphine complex: a carbene-exchange reagent.
• Authors of publication: Xu, Huihui; León Baeza, José Miguel; Baceiredo, Antoine; Rojas Guerrero, René Segundo; Saffon-Merceron, Nathalie; Branchadell, Vicenç; Kato, Tsuyoshi
• Journal of publication: Chemical science
• Year of publication: 2025
• Journal volume: 16
• Journal issue: 31
• Pages of publication: 14225 - 14230
• a: 24.8337 ± 0.0012 Å
• b: 10.5705 ± 0.0005 Å
• c: 25.3214 ± 0.0012 Å
• α: 90°
• β: 109.228 ± 0.002°
• γ: 90°
• Cell volume: 6276.2 ± 0.5 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 8
• 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: 0.092
• Residual factor for significantly intense reflections: 0.0606
• Weighted residual factors for significantly intense reflections: 0.1494
• Weighted residual factors for all reflections included in the refinement: 0.1714
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No