Information card for entry 1555781

Structure parameters

• Formula: C15 H25 Br O2
• Calculated formula: C15 H25 Br O2
• Title of publication: Strategies for the Total Synthesis of Diverse Bromo-Chamigrenes.
• Authors of publication: Shen, Minxing; Kretschmer, Manuel; Brill, Zachary G.; Snyder, Scott A.
• Journal of publication: Organic letters
• Year of publication: 2016
• Journal volume: 18
• Journal issue: 19
• Pages of publication: 5018 - 5021
• a: 10.9219 ± 0.0007 Å
• b: 22.3462 ± 0.0014 Å
• c: 13.7789 ± 0.0009 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3362.9 ± 0.4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0848
• Residual factor for significantly intense reflections: 0.0452
• Weighted residual factors for significantly intense reflections: 0.0983
• Weighted residual factors for all reflections included in the refinement: 0.1115
• Goodness-of-fit parameter for all reflections included in the refinement: 1.016
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No