Information card for entry 2235747

Structure parameters

• Chemical name: 1,3-Dinitrosoimidazolidine
• Formula: C3 H6 N4 O2
• Calculated formula: C3 H6 N4 O2
• Title of publication: 1,3-Dinitrosoimidazolidine
• Authors of publication: Rivera, Augusto; Quiroga, Diego; Ríos-Motta, Jaime; Dušek, Michal; Fejfarová, Karla
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 8
• Pages of publication: o2440
• a: 9.5154 ± 0.0002 Å
• b: 5.4338 ± 0.0001 Å
• c: 10.7104 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 553.779 ± 0.019 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 K
• Number of distinct elements: 4
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0397
• Residual factor for significantly intense reflections: 0.0394
• Weighted residual factors for significantly intense reflections: 0.1257
• Weighted residual factors for all reflections included in the refinement: 0.126
• Goodness-of-fit parameter for all reflections included in the refinement: 2.86
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes