Information card for entry 2005476

Structure parameters

• Common name: Maleimide
• Formula: C4 H3 N O2
• Calculated formula: C4 H3 N O2
• SMILES: O=C1NC(=O)C=C1
• Title of publication: Maleimide
• Authors of publication: Cox, P. J.; Parker, S. F.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1996
• Journal volume: 52
• Journal issue: 10
• Pages of publication: 2578 - 2580
• a: 6.768 ± 0.012 Å
• b: 10.675 ± 0.014 Å
• c: 12.384 ± 0.012 Å
• α: 81.37 ± 0.05°
• β: 77.01 ± 0.05°
• γ: 74.77 ± 0.12°
• Cell volume: 837 ± 2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1407
• Residual factor for significantly intense reflections: 0.063
• Weighted residual factors for all reflections: 0.1715
• Weighted residual factors for significantly intense reflections: 0.1398
• Goodness-of-fit parameter for all reflections: 0.764
• Goodness-of-fit parameter for significantly intense reflections: 1.123
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No