Information card for entry 1574962

Structure parameters

• Formula: C62 H101 Al N5 O P Si
• Calculated formula: C62 H101 Al N5 O 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: 12.0584 ± 0.0009 Å
• b: 13.9968 ± 0.0009 Å
• c: 18.0629 ± 0.0013 Å
• α: 90.561 ± 0.002°
• β: 92.765 ± 0.002°
• γ: 98.516 ± 0.002°
• Cell volume: 3011.1 ± 0.4 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1175
• Residual factor for significantly intense reflections: 0.0661
• Weighted residual factors for significantly intense reflections: 0.1736
• Weighted residual factors for all reflections included in the refinement: 0.2024
• Goodness-of-fit parameter for all reflections included in the refinement: 1.047
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No