Information card for entry 2009640

Structure parameters

• Chemical name: 2,5-dimethyl-4-nitroimidazole
• Formula: C5 H7 N3 O2
• Calculated formula: C5 H7 N3 O2
• Title of publication: 2,5-Dimethyl-4-nitroimidazole
• Authors of publication: Olszak, Tomasz A.; Peeters, O.M.; Blaton, N.M.; De Ranter, C.J.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1994
• Journal volume: 50
• Journal issue: 4
• Pages of publication: 558 - 559
• a: 7.724 ± 0.001 Å
• b: 10.513 ± 0.001 Å
• c: 16.034 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1302 ± 0.3 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P c a b
• Hall space group symbol: -P 2bc 2ac
• Residual factor for significantly intense reflections: 0.0377
• Weighted residual factors for significantly intense reflections: 0.0349
• Goodness-of-fit parameter for significantly intense reflections: 0.7693
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No