Information card for entry 2007263

Structure parameters

• Formula: C26 H25 N O3
• Calculated formula: C26 H25 N O3
• SMILES: N1(C2=C(C(=O)CCC2)C(C2=C1CCCC2=O)c1ccc(OC)cc1)c1ccccc1
• Title of publication: 9-(4-Methoxyphenyl)-10-phenyl-3,4,6,7,9,10-hexahydro-1,8(2<i>H</i>,5<i>H</i>)-acridinedione
• Authors of publication: V.K. Ganesh; S.Banumathi; D.Velmurugan; N. Ramasubbu; V.T.Ramakrishnan
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1998
• Journal volume: 54
• Journal issue: 5
• Pages of publication: 633 - 635
• a: 8.6696 ± 0.0007 Å
• b: 11.1396 ± 0.0007 Å
• c: 21.1975 ± 0.0007 Å
• α: 90°
• β: 92.49 ± 0.02°
• γ: 90°
• Cell volume: 2045.2 ± 0.2 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: 0.0722
• Residual factor for significantly intense reflections: 0.0511
• Weighted residual factors for all reflections: 0.1762
• Weighted residual factors for significantly intense reflections: 0.1522
• Goodness-of-fit parameter for all reflections: 0.61
• Goodness-of-fit parameter for significantly intense reflections: 0.612
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No