Information card for entry 7124382

Structure parameters

• Formula: C23 H26 O6
• Calculated formula: C23 H26 O6
• Title of publication: Construction of Seven- and Eight-Membered Carbocycles by Lewis Acid Catalyzed C(sp3)‒H Bond Functionalization
• Authors of publication: Otawa, Yuna; Mori, Keiji
• Journal of publication: Chemical Communications
• Year of publication: 2019
• a: 10.467 ± 0.006 Å
• b: 18.051 ± 0.009 Å
• c: 22.288 ± 0.012 Å
• α: 88.516 ± 0.008°
• β: 82.089 ± 0.008°
• γ: 89.724 ± 0.009°
• Cell volume: 4170 ± 4 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 K
• Number of distinct elements: 3
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2368
• Residual factor for significantly intense reflections: 0.1023
• Weighted residual factors for significantly intense reflections: 0.1712
• Weighted residual factors for all reflections included in the refinement: 0.2281
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No