Information card for entry 1558830

Structure parameters

• Chemical name: 1-Hydroxy-3,4-dimethoxy-10-methylacridin-9-one
• Formula: C16 H15 N O4
• Calculated formula: C16 H15 N O4
• SMILES: O(c1c2N(c3c(C(=O)c2c(O)cc1OC)cccc3)C)C
• Title of publication: 1-Hydroxy-3,4-dimethoxy-10-methylacridin-9-one
• Authors of publication: Araújo, Rodrigo S. A. de; Zondegoumba, Ernestine N. T.; Tankoua, Whisthler L. D.; Nyassé, Barthelemy; Mendonça, Francisco J. B. F.; De Simone, Carlos A.
• Journal of publication: IUCrData
• Year of publication: 2020
• Journal volume: 5
• Journal issue: 8
• Pages of publication: x201005
• a: 8.336 ± 0.0002 Å
• b: 10.178 ± 0.0003 Å
• c: 16.326 ± 0.0004 Å
• α: 82.284 ± 0.002°
• β: 76.557 ± 0.002°
• γ: 87.081 ± 0.002°
• Cell volume: 1334.73 ± 0.06 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0723
• Residual factor for significantly intense reflections: 0.0567
• Weighted residual factors for significantly intense reflections: 0.1687
• Weighted residual factors for all reflections included in the refinement: 0.1837
• Goodness-of-fit parameter for all reflections included in the refinement: 1.06
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No