Information card for entry 4067237

Structure parameters

• Formula: C62.4 H70 Br2 Mg2 O7.2
• Calculated formula: C62.4 H70 Br2 Mg2 O7.2
• Title of publication: Alkali Metal-Stabilized 1,3,5-Triphenylbenzene Monoanions: Synthesis and Characterization of the Lithium, Sodium, and Potassium Complexes†
• Authors of publication: Krieck, Sven; Görls, Helmar; Westerhausen, Matthias
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 24
• Pages of publication: 6790
• a: 7.5104 ± 0.0003 Å
• b: 10.7441 ± 0.0005 Å
• c: 19.2715 ± 0.0009 Å
• α: 87.816 ± 0.003°
• β: 79.614 ± 0.003°
• γ: 76.216 ± 0.003°
• Cell volume: 1485.52 ± 0.12 ų
• Cell temperature: 183 ± 2 K
• Ambient diffraction temperature: 183 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.104
• Residual factor for significantly intense reflections: 0.0624
• Weighted residual factors for significantly intense reflections: 0.1537
• Weighted residual factors for all reflections included in the refinement: 0.1753
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No