Information card for entry 4037435

Structure parameters

• Formula: C24 H17 Br
• Calculated formula: C24 H17 Br
• Title of publication: N-Heterocyclic Carbene/Lewis Acid Dual Catalysis for the Divergent Construction of Enantiopure Bridged Lactones and Fused Indenes.
• Authors of publication: Wang, Zhan-Yong; Ding, Ya-Li; Li, Shi-Ning; Cheng, Ying
• Journal of publication: The Journal of organic chemistry
• Year of publication: 2016
• Journal volume: 81
• Journal issue: 23
• Pages of publication: 11871 - 11881
• a: 19.517 ± 0.008 Å
• b: 11.699 ± 0.005 Å
• c: 7.487 ± 0.003 Å
• α: 90°
• β: 93.387 ± 0.007°
• γ: 90°
• Cell volume: 1706.5 ± 1.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 3
• 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: 0.0751
• Residual factor for significantly intense reflections: 0.0701
• Weighted residual factors for significantly intense reflections: 0.1788
• Weighted residual factors for all reflections included in the refinement: 0.1807
• Goodness-of-fit parameter for all reflections included in the refinement: 1.3
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No