Information card for entry 3000415

Structure parameters

• Formula: C19 H20 O6
• Calculated formula: C19 H20 O6
• Authors of publication: Phansuang Udomputtimekakul
• Journal of publication: Personal communication to COD
• Year of publication: 2022
• a: 6.4 ± 0.0001 Å
• b: 9.9684 ± 0.0002 Å
• c: 25.9394 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1654.88 ± 0.06 ų
• Cell temperature: 296.15 K
• Ambient diffraction temperature: 296.15 K
• Number of distinct elements: 3
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0571
• Residual factor for significantly intense reflections: 0.0393
• Weighted residual factors for significantly intense reflections: 0.0822
• Weighted residual factors for all reflections included in the refinement: 0.0896
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Diffraction radiation X-ray symbol: K-L~3~
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No