Information card for entry 2221069

Structure parameters

• Chemical name: <i>N</i>-phenylphthalimide
• Formula: C14 H9 N O2
• Calculated formula: C14 H9 N O2
• SMILES: O=C1N(c2ccccc2)C(=O)c2c1cccc2
• Title of publication: A new polymorph of <i>N</i>-phenylphthalimide
• Authors of publication: Izotova, L. Yu.; Ashurov, J. M.; Ibragimov, B. T.; Weber, E.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 3
• Pages of publication: o658
• a: 5.548 ± 0.0011 Å
• b: 23.801 ± 0.005 Å
• c: 8.025 ± 0.0016 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1059.7 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.1157
• Residual factor for significantly intense reflections: 0.0668
• Weighted residual factors for significantly intense reflections: 0.1141
• Weighted residual factors for all reflections included in the refinement: 0.1374
• Goodness-of-fit parameter for all reflections included in the refinement: 1.171
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes