Information card for entry 1555337

Structure parameters

• Formula: C17 H20 O3
• Calculated formula: C17 H20 O3
• Title of publication: Two Enantiomeric Pairs of Meroterpenoids from Rhododendron capitatum.
• Authors of publication: Liao, Hai-Bing; Lei, Chun; Gao, Li-Xin; Li, Jing-Ya; Li, Jia; Hou, Ai-Jun
• Journal of publication: Organic letters
• Year of publication: 2015
• Journal volume: 17
• Journal issue: 20
• Pages of publication: 5040 - 5043
• a: 8.3018 ± 0.0001 Å
• b: 14.7835 ± 0.0002 Å
• c: 12.3636 ± 0.0002 Å
• α: 90°
• β: 101.126 ± 0.001°
• γ: 90°
• Cell volume: 1488.86 ± 0.04 ų
• Cell temperature: 140 ± 2 K
• Ambient diffraction temperature: 140 ± 2 K
• Number of distinct elements: 3
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0326
• Residual factor for significantly intense reflections: 0.0322
• Weighted residual factors for significantly intense reflections: 0.0895
• Weighted residual factors for all reflections included in the refinement: 0.09
• Goodness-of-fit parameter for all reflections included in the refinement: 1.067
• Diffraction radiation wavelength: 1.54178 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No