Information card for entry 2005490

Structure parameters

• Formula: C26 H31 N O4
• Calculated formula: C26 H31 N O4
• SMILES: C1C(CC(=O)C2=C1N(C1=C(C2COC(=O)C)C(=O)CC(C1)(C)C)c1ccccc1)(C)C
• Title of publication: 3,4,6,7,9,10-Hexahydro-3,3,6,6-tetramethyl-1,8(2<i>H</i>,5<i>H</i>)-dioxo-10-phenyl-9-acridinylmethyl Acetate
• Authors of publication: Gunasekaran, K.; Velmurugan, D.; Murugan, P.; Ramakrishnan, V. T.; Panneerselvam, K.; Soriano-García, M.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1996
• Journal volume: 52
• Journal issue: 10
• Pages of publication: 2609 - 2612
• a: 13.616 ± 0.001 Å
• b: 11.977 ± 0.002 Å
• c: 15.804 ± 0.001 Å
• α: 90°
• β: 111.09 ± 0.02°
• γ: 90°
• Cell volume: 2404.7 ± 0.6 ų
• Cell temperature: 293 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 significantly intense reflections: 0.0516
• Weighted residual factors for significantly intense reflections: 0.134
• Goodness-of-fit parameter for significantly intense reflections: 0.903
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No