Information card for entry 7133800

Structure parameters

• Formula: C81.3 H50.2 Al2 Cl2 F21 N4 P2
• Calculated formula: C81.3 H50.2 Al2 Cl2 F21 N4 P2
• Title of publication: Reactivity of N-(isocyanoimino)triphenylphosphorane toward group 13 Lewis acids
• Authors of publication: Ju, Shaoying; Yan, Weili; Stephan, Douglas W.; Wu, Yile; Chen, Ting; Tang , Beili
• Journal of publication: Chemical Communications
• Year of publication: 2024
• a: 15.3044 ± 0.0006 Å
• b: 25.9421 ± 0.0011 Å
• c: 19.9557 ± 0.0008 Å
• α: 90°
• β: 109.49 ± 0.002°
• γ: 90°
• Cell volume: 7469 ± 0.5 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 7
• 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: 0.0503
• Residual factor for significantly intense reflections: 0.0445
• Weighted residual factors for significantly intense reflections: 0.1163
• Weighted residual factors for all reflections included in the refinement: 0.1196
• Goodness-of-fit parameter for all reflections included in the refinement: 1.097
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No