Information card for entry 7011923

Structure parameters

• Formula: C51.5 H66 Cl4 N4
• Calculated formula: C51.5 H66 Cl4 N4
• Title of publication: Double lithiation of 2,4,6-triphenylbromobenzene: synthesis of bis-amidines and an aluminium bis-amidinate complex
• Authors of publication: Jenkins, Hilary A.; Abeysekera, Deepa; Dickie, Diane A.; Clyburne, Jason A. C.
• Journal of publication: Journal of the Chemical Society, Dalton Transactions
• Year of publication: 2002
• Journal issue: 20
• Pages of publication: 3919
• a: 16.3 ± 0.002 Å
• b: 15.3088 ± 0.0019 Å
• c: 20.157 ± 0.003 Å
• α: 90°
• β: 95.115 ± 0.002°
• γ: 90°
• Cell volume: 5009.8 ± 1.1 ų
• Cell temperature: 213 ± 2 K
• Ambient diffraction temperature: 213 ± 2 K
• Number of distinct elements: 4
• Space group number: 9
• Hermann-Mauguin space group symbol: C 1 c 1
• Hall space group symbol: C -2yc
• Residual factor for all reflections: 0.0693
• Residual factor for significantly intense reflections: 0.0596
• Weighted residual factors for significantly intense reflections: 0.1693
• Weighted residual factors for all reflections included in the refinement: 0.1764
• Goodness-of-fit parameter for all reflections included in the refinement: 0.997
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No