Information card for entry 2226096

Structure parameters

• Chemical name: Cyclohexanone 2-nitrophenylhydrazone
• Formula: C12 H15 N3 O2
• Calculated formula: C12 H15 N3 O2
• SMILES: O=N(=O)c1ccccc1NN=C1CCCCC1
• Title of publication: Cyclohexanone 2-nitrophenylhydrazone
• Authors of publication: Yang, Bao-he; Niu, Jun-long
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 6
• Pages of publication: o1300
• a: 8.519 ± 0.005 Å
• b: 19.609 ± 0.007 Å
• c: 7.822 ± 0.004 Å
• α: 90°
• β: 112.11 ± 0.007°
• γ: 90°
• Cell volume: 1210.6 ± 1 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/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1741
• Residual factor for significantly intense reflections: 0.0351
• Weighted residual factors for significantly intense reflections: 0.0532
• Weighted residual factors for all reflections included in the refinement: 0.066
• Goodness-of-fit parameter for all reflections included in the refinement: 0.64
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes