Information card for entry 1574961

Structure parameters

• Formula: C46 H79 Al N5 P Si
• Calculated formula: C46 H79 Al 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: 12.659 ± 0.001 Å
• b: 17.5105 ± 0.0012 Å
• c: 20.6407 ± 0.0015 Å
• α: 90°
• β: 90.19 ± 0.003°
• γ: 90°
• Cell volume: 4575.3 ± 0.6 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 6
• 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: 0.0799
• Residual factor for significantly intense reflections: 0.0458
• Weighted residual factors for significantly intense reflections: 0.1026
• Weighted residual factors for all reflections included in the refinement: 0.1197
• Goodness-of-fit parameter for all reflections included in the refinement: 1.026
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No