Information card for entry 2007405

Structure parameters

• Formula: C21 H24 N2 O2
• Calculated formula: C21 H24 N2 O2
• SMILES: O=C1CCCC2=C1C(C1=C(N2)CCCC1=O)c1ccc(N(C)C)cc1
• Title of publication: 9-(4-Dimethylaminophenyl)-3,4,6,7,9,10-hexahydro-1,8(2<i>H</i>,5<i>H</i>)-acridinedione
• Authors of publication: S. Selladurai; R. Chandrasekaran; L. Govindasamy; Il-Hwan Suh
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 7
• Pages of publication: 957 - 959
• a: 8.574 ± 0.001 Å
• b: 30.57 ± 0.009 Å
• c: 7.0473 ± 0.0008 Å
• α: 90°
• β: 100.53 ± 0.01°
• γ: 90°
• Cell volume: 1816 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.116
• Residual factor for significantly intense reflections: 0.049
• Weighted residual factors for all reflections: 0.291
• Weighted residual factors for all reflections included in the refinement: 0.291
• Goodness-of-fit parameter for all reflections: 1.616
• Goodness-of-fit parameter for all reflections included in the refinement: 1.091
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No