Information card for entry 2238396

Structure parameters

• Common name: <i>N</i>-Methyl-5-nitrosalicylhydrazide
• Chemical name: 2-Hydroxy-<i>N</i>'-methyl-5-nitrobenzohydrazide
• Formula: C8 H9 N3 O4
• Calculated formula: C8 H9 N3 O4
• SMILES: c1(c(ccc(c1)N(=O)=O)[O-])C(=O)N[NH2+]C.c1(c(ccc(c1)N(=O)=O)O)C(=O)NNC
• Title of publication: 2-Hydroxy-<i>N</i>'-methyl-5-nitrobenzohydrazide
• Authors of publication: Yang, Ming; Jin, Chengzhi; Zhou, Xiaodong; Jin, Longfei
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2013
• Journal volume: 69
• Journal issue: 8
• Pages of publication: o1305
• a: 7.3818 ± 0.0015 Å
• b: 13.106 ± 0.003 Å
• c: 18.719 ± 0.004 Å
• α: 90°
• β: 95.25 ± 0.03°
• γ: 90°
• Cell volume: 1803.4 ± 0.7 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/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0946
• Residual factor for significantly intense reflections: 0.0583
• Weighted residual factors for significantly intense reflections: 0.1245
• Weighted residual factors for all reflections included in the refinement: 0.1419
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes