Information card for entry 2011339

Structure parameters

• Chemical name: 10-(benzoylamino)-3,4,6,7,9,10-hexahydro-1,8-(2H,5H)-acridinedione (I)
• Formula: C20 H22 N2 O4
• Calculated formula: C20 H22 N2 O4
• SMILES: O=C1C2=C(CCC1)N(C1=C(C(=O)CCC1)C2)NC(=O)c1ccccc1.O
• Title of publication: Two benzoylaminoacridinedione derivatives
• Authors of publication: Jeyakanthan, J.; Shanmuga Sundara Raj, S.; Velmurugan, D.; Fun, Hoong-Kun; Rajan, T. Joseph; Ramakrishnan, V.T.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 2000
• Journal volume: 56
• Journal issue: 9
• Pages of publication: 1109 - 1112
• a: 11.4056 ± 0.0002 Å
• b: 12.2501 ± 0.0001 Å
• c: 13.1746 ± 0.0003 Å
• α: 90°
• β: 91.497 ± 0.001°
• γ: 90°
• Cell volume: 1840.12 ± 0.05 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/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0842
• Residual factor for significantly intense reflections: 0.0561
• Weighted residual factors for all reflections included in the refinement: 0.167
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes