Information card for entry 2218709

Structure parameters

• Chemical name: 9,10-Dihydroxy-4,4-dimethyl-5,8-dihydroanthracen-1(4<i>H</i>)-one
• Formula: C16 H16 O3
• Calculated formula: C16 H16 O3
• Title of publication: 9,10-Dihydroxy-4,4-dimethyl-5,8-dihydroanthracen-1(4<i>H</i>)-one
• Authors of publication: Ramírez-Rodríguez, Oney; Martínez-Cifuentes, Maximiliano; Ibañez, Andres; Vega, Andrés; Araya-Maturana, Ramiro
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 7
• Pages of publication: o1316
• a: 8.5944 ± 0.0005 Å
• b: 7.6024 ± 0.0005 Å
• c: 19.2949 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1260.69 ± 0.14 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 3
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0529
• Residual factor for significantly intense reflections: 0.0439
• Weighted residual factors for significantly intense reflections: 0.1114
• Weighted residual factors for all reflections included in the refinement: 0.1177
• Goodness-of-fit parameter for all reflections included in the refinement: 1.006
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes