Information card for entry 8103096

Structure parameters

• Chemical name: (<i>S</i>)-6,6'-Dibromo-2,2'-diethoxy-1,1'-binaphthyl
• Formula: C24 H20 Br2 O2
• Calculated formula: C24 H20 Br2 O2
• SMILES: Brc1cc2ccc(c(c2cc1)c1c2ccc(Br)cc2ccc1OCC)OCC
• Title of publication: Crystal structure of (S)-6,6'-dibromo-2,2'-diethoxy-1,1'-binaphthyl, C24H20Br2O2
• Authors of publication: Lin-Lin Jing; Hai-Bo Wang; Xiao-Li Sun; Hui-Ping Ma; Zheng-Ping Jia
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2011
• Journal volume: 226
• Journal issue: 1
• Pages of publication: 117
• a: 7.402 ± 0.0008 Å
• b: 16.6206 ± 0.0018 Å
• c: 17.3609 ± 0.0018 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2135.8 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0678
• Residual factor for significantly intense reflections: 0.0458
• Weighted residual factors for significantly intense reflections: 0.1268
• Weighted residual factors for all reflections included in the refinement: 0.1391
• 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