Information card for entry 2231136

Structure parameters

• Chemical name: 1-[(<i>Z</i>)-2-Phenylhydrazin-1-ylidene]-1-(piperidin-1-yl)propan-2-one
• Formula: C14 H19 N3 O
• Calculated formula: C14 H19 N3 O
• SMILES: O=C(C(=N\Nc1ccccc1)\N1CCCCC1)C
• Title of publication: 1-[(<i>Z</i>)-2-Phenylhydrazin-1-ylidene]-1-(piperidin-1-yl)propan-2-one
• Authors of publication: Abdel-Aziz, Hatem A.; Ng, Seik Weng; Tiekink, Edward R. T.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2011
• Journal volume: 67
• Journal issue: 8
• Pages of publication: o2172
• a: 9.1195 ± 0.0002 Å
• b: 11.9614 ± 0.0002 Å
• c: 12.0393 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1313.27 ± 0.04 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.0344
• Residual factor for significantly intense reflections: 0.0327
• Weighted residual factors for significantly intense reflections: 0.0784
• Weighted residual factors for all reflections included in the refinement: 0.0803
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes