Information card for entry 4508791

Structure parameters

• Chemical name: 1,1'-binaphthyl-2,2'-dicarboxylic acid 1,4-dioxane clathrate
• Formula: C26 H22 O6
• Calculated formula: C26 H22 O6
• Title of publication: Growth of Six Different Crystals of the Versatile Host Compound 1,1‘-Binaphthyl-2,2‘-dicarboxylic Acid from Solutions in 1,4-Dioxane
• Authors of publication: Izotova, Lidiya; Ibragimov, Bakhtiyar; Ashurov, Jamshid; Talipov, Samat; Weber, Edwin
• Journal of publication: Crystal Growth & Design
• Year of publication: 2006
• Journal volume: 6
• Journal issue: 11
• Pages of publication: 2523
• a: 9.593 ± 0.007 Å
• b: 10.515 ± 0.007 Å
• c: 12.504 ± 0.009 Å
• α: 109.84 ± 0.05°
• β: 93.13 ± 0.06°
• γ: 106.52 ± 0.05°
• Cell volume: 1121.4 ± 1.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1652
• Residual factor for significantly intense reflections: 0.0817
• Weighted residual factors for significantly intense reflections: 0.1039
• Weighted residual factors for all reflections included in the refinement: 0.133
• Goodness-of-fit parameter for all reflections included in the refinement: 1.172
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No