Information card for entry 1555783

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: 31.909 ± 0.002 Å
• b: 22.347 ± 0.002 Å
• c: 13.1317 ± 0.0009 Å
• α: 90°
• β: 97.044 ± 0.003°
• γ: 90°
• Cell volume: 9293.2 ± 1.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.097
• Residual factor for significantly intense reflections: 0.0754
• Weighted residual factors for significantly intense reflections: 0.1592
• Weighted residual factors for all reflections included in the refinement: 0.1685
• Goodness-of-fit parameter for all reflections included in the refinement: 1.113
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No