Information card for entry 2003972

Structure parameters

• Formula: C15 H10 O2
• Calculated formula: C16 H6 O2
• SMILES: Cc1ccc2c(c1)C(=O)c1c(C2=O)cccc1
• Title of publication: Disordered Structure of 2-Methylanthraquinone
• Authors of publication: Kingsford-Adaboh, R.; Kashino, S.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 10
• Pages of publication: 2094 - 2096
• a: 3.86 ± 0.01 Å
• b: 12.771 ± 0.006 Å
• c: 10.994 ± 0.004 Å
• α: 90°
• β: 93.93 ± 0.08°
• γ: 90°
• Cell volume: 540.7 ± 1.4 ų
• Cell temperature: 295 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.061
• Weighted residual factors for significantly intense reflections: 0.058
• Goodness-of-fit parameter for significantly intense reflections: 2.21
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No