Information card for entry 2223237

Structure parameters

• Chemical name: 1-(Butan-2-ylidene)-2-(2-nitrophenyl)hydrazine
• Formula: C10 H13 N3 O2
• Calculated formula: C10 H13 N3 O2
• SMILES: N(=C(CC)\C)\Nc1ccccc1N(=O)=O
• Title of publication: 1-(Butan-2-ylidene)-2-(2-nitrophenyl)hydrazine
• Authors of publication: Qian, Heng-yu; Yin, Zhi-gang; Yao, Zhi-qiang
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2009
• Journal volume: 65
• Journal issue: 9
• Pages of publication: o2155
• a: 7.3079 ± 0.0011 Å
• b: 10.215 ± 0.0017 Å
• c: 14.763 ± 0.002 Å
• α: 90°
• β: 100.058 ± 0.009°
• γ: 90°
• Cell volume: 1085.1 ± 0.3 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 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: 0.1009
• Residual factor for significantly intense reflections: 0.0474
• Weighted residual factors for significantly intense reflections: 0.1372
• Weighted residual factors for all reflections included in the refinement: 0.1588
• Goodness-of-fit parameter for all reflections included in the refinement: 0.931
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes