Information card for entry 2236935

Structure parameters

• Chemical name: 2-(2-Nitrophenyl)acetohydrazide
• Formula: C8 H9 N3 O3
• Calculated formula: C8 H9 N3 O3
• SMILES: O=C(NN)Cc1c(N(=O)=O)cccc1
• Title of publication: 2-(2-Nitrophenyl)acetohydrazide
• Authors of publication: Praveen, A. S.; Jasinski, Jerry P.; Keeley, Amanda C.; Yathirajan, H. S.; Narayana, B.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2012
• Journal volume: 68
• Journal issue: 12
• Pages of publication: o3436
• a: 6.6962 ± 0.0005 Å
• b: 4.9388 ± 0.0004 Å
• c: 13.3593 ± 0.0012 Å
• α: 90°
• β: 92.361 ± 0.008°
• γ: 90°
• Cell volume: 441.43 ± 0.06 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.041
• Residual factor for significantly intense reflections: 0.0377
• Weighted residual factors for significantly intense reflections: 0.0916
• Weighted residual factors for all reflections included in the refinement: 0.0957
• Goodness-of-fit parameter for all reflections included in the refinement: 1.045
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes