Information card for entry 1545647

Structure parameters

• Chemical name: Ethyl 2-(6-nitro-1<i>H</i>-indazol-1-yl)acetate
• Formula: C11 H11 N3 O4
• Calculated formula: C11 H11 N3 O4
• Title of publication: Ethyl 2-(6-nitro-1<i>H</i>-indazol-1-yl)acetate
• Authors of publication: Mohamed Abdelahi, Mohamed Mokhtar; El Bakri, Youness; Benchidmi, Mohammed; Essassi, El Mokhtar; Mague, Joel T.
• Journal of publication: IUCrData
• Year of publication: 2017
• Journal volume: 2
• Journal issue: 3
• Pages of publication: x170432
• a: 12.6867 ± 0.0006 Å
• b: 21.7492 ± 0.001 Å
• c: 8.1393 ± 0.0004 Å
• α: 90°
• β: 90.772 ± 0.001°
• γ: 90°
• Cell volume: 2245.64 ± 0.18 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0581
• Residual factor for significantly intense reflections: 0.0505
• Weighted residual factors for significantly intense reflections: 0.1376
• Weighted residual factors for all reflections included in the refinement: 0.1419
• Goodness-of-fit parameter for all reflections included in the refinement: 1.037
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes