Information card for entry 2208526

Structure parameters

• Chemical name: N-Benzyl-indole-2,3-dione(N-benzylisatin)
• Formula: C15 H11 N O2
• Calculated formula: C15 H11 N O2
• SMILES: O=C1c2c(N(C1=O)Cc1ccccc1)cccc2
• Title of publication: <i>N</i>-Benzylindole-2,3-dione (<i>N</i>-benzylisatin)
• Authors of publication: Mehmet Akkurt; Sevim Türktekin; Ali Asghar Jarrahpour; Dariush Khalili; Orhan Büyükgüngör
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 4
• Pages of publication: o1575 - o1577
• a: 7.61 ± 0.003 Å
• b: 11.311 ± 0.002 Å
• c: 13.422 ± 0.004 Å
• α: 90°
• β: 90.16 ± 0.03°
• γ: 90°
• Cell volume: 1155.3 ± 0.6 ų
• Cell temperature: 296 K
• Ambient diffraction temperature: 296 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: 0.0472
• Residual factor for significantly intense reflections: 0.0394
• Weighted residual factors for significantly intense reflections: 0.0948
• Weighted residual factors for all reflections included in the refinement: 0.099
• Goodness-of-fit parameter for all reflections included in the refinement: 1.073
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes