Information card for entry 2223908

Structure parameters

• Chemical name: (<i>Z</i>)-4-Amino-1,2,5-oxadiazole-3-carboxamide oxime
• Formula: C3 H5 N5 O2
• Calculated formula: C3 H5 N5 O2
• SMILES: O/N=C(/c1nonc1N)N
• Title of publication: (<i>Z</i>)-4-Amino-1,2,5-oxadiazole-3-carboxamide oxime
• Authors of publication: Zhang, Hui; Jian, Fang-fang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 11
• Pages of publication: o2911
• a: 7.6514 ± 0.0015 Å
• b: 11.712 ± 0.002 Å
• c: 19.218 ± 0.004 Å
• α: 90°
• β: 96.53 ± 0.03°
• γ: 90°
• Cell volume: 1711 ± 0.6 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0517
• Residual factor for significantly intense reflections: 0.0414
• Weighted residual factors for significantly intense reflections: 0.1224
• Weighted residual factors for all reflections included in the refinement: 0.1305
• Goodness-of-fit parameter for all reflections included in the refinement: 0.879
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes