Information card for entry 1529849

Structure parameters

• Formula: C37 H54 O6 Si
• Calculated formula: C34 H47 O6 Si
• Title of publication: Synthetic Study on Naphthospironone A: Construction of Benzobicyclo[3.2.1]octene Skeleton with Oxaspirocycle.
• Authors of publication: Sakata, Juri; Ando, Yoshio; Ohmori, Ken; Suzuki, Keisuke
• Journal of publication: Organic letters
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 15
• Pages of publication: 3746 - 3749
• a: 9.8958 ± 0.0004 Å
• b: 32.0974 ± 0.0012 Å
• c: 20.6189 ± 0.0009 Å
• α: 90°
• β: 92.873 ± 0.002°
• γ: 90°
• Cell volume: 6540.9 ± 0.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• 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: 0.0934
• Residual factor for significantly intense reflections: 0.0642
• Weighted residual factors for significantly intense reflections: 0.1518
• Weighted residual factors for all reflections included in the refinement: 0.1698
• Goodness-of-fit parameter for all reflections included in the refinement: 1.05
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No