Information card for entry 2202439

Structure parameters

• Formula: C10 H6 N2 O4
• Calculated formula: C10 H6 N2 O4
• SMILES: c1c(N2C(=O)C=CC2=O)ccc(c1)N(=O)=O
• Title of publication: <i>p</i>-Nitrophenylmaleimide
• Authors of publication: Moreno-Fuquen, Rodolfo; Valencia, Hoover; Abonia, Rodrigo; Kennedy, Alan R.; Graham Duncan
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 11
• Pages of publication: o1717 - o1718
• a: 10.535 ± 0.002 Å
• b: 11.624 ± 0.003 Å
• c: 8.148 ± 0.002 Å
• α: 90°
• β: 109.69 ± 0.03°
• γ: 90°
• Cell volume: 939.5 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0344
• Residual factor for significantly intense reflections: 0.0302
• Weighted residual factors for significantly intense reflections: 0.0815
• Weighted residual factors for all reflections included in the refinement: 0.0845
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes