Information card for entry 7160781

Structure parameters

• Formula: C35 H22 Br Cl O2
• Calculated formula: C35 H22 Br Cl O2
• Title of publication: Expedient regioselective synthesis of all-different tetraaryl furans.
• Authors of publication: Bu, Shixuan; Wang, Haoran; Wang, Sunewang R.
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2025
• Journal volume: 23
• Journal issue: 42
• Pages of publication: 9602 - 9607
• a: 5.9069 ± 0.0002 Å
• b: 28.0225 ± 0.0008 Å
• c: 15.8563 ± 0.0004 Å
• α: 90°
• β: 93.222 ± 0.003°
• γ: 90°
• Cell volume: 2620.48 ± 0.13 ų
• Cell temperature: 172.95 ± 0.11 K
• Ambient diffraction temperature: 172.95 ± 0.11 K
• Number of distinct elements: 5
• 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: 0.0809
• Residual factor for significantly intense reflections: 0.0742
• Weighted residual factors for significantly intense reflections: 0.202
• Weighted residual factors for all reflections included in the refinement: 0.2055
• Goodness-of-fit parameter for all reflections included in the refinement: 1.134
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No