Information card for entry 2216147

Structure parameters

• Chemical name: Ethyl (E)-2-(4-chlorobenzylidene)hydrazinecarboxylate
• Formula: C10 H11 Cl N2 O2
• Calculated formula: C10 H11 Cl N2 O2
• SMILES: Clc1ccc(cc1)/C=N/NC(=O)OCC
• Title of publication: Ethyl (<i>E</i>)-2-(4-chlorobenzylidene)hydrazinecarboxylate
• Authors of publication: Bo Gao
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2007
• Journal volume: 63
• Journal issue: 11
• Pages of publication: o4418 - o4418
• a: 16.317 ± 0.004 Å
• b: 8.3488 ± 0.0016 Å
• c: 18.035 ± 0.004 Å
• α: 90°
• β: 116.014 ± 0.004°
• γ: 90°
• Cell volume: 2207.9 ± 0.8 ų
• Cell temperature: 193 ± 2 K
• Ambient diffraction temperature: 193 ± 2 K
• Number of distinct elements: 5
• 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: 0.061
• Residual factor for significantly intense reflections: 0.049
• Weighted residual factors for significantly intense reflections: 0.105
• Weighted residual factors for all reflections included in the refinement: 0.111
• Goodness-of-fit parameter for all reflections included in the refinement: 1.16
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes