Information card for entry 2207503

Structure parameters

• Chemical name: r-2,c-6-Bis(4-chlorophenyl)-t-3,t-5-dimethyl-1-nitrosopiperidin-4-one oxime
• Formula: C19 H19 Cl2 N3 O2
• Calculated formula: C19 H19 Cl2 N3 O2
• SMILES: Clc1ccc([C@H]2N(N=O)[C@H]([C@@H](C(=NO)[C@@H]2C)C)c2ccc(Cl)cc2)cc1
• Title of publication: <i>r</i>-2,<i>c</i>-6-Bis(4-chlorophenyl)-<i>t</i>-3,<i>t</i>-5-dimethyl-1-nitrosopiperidin-4-one oxime
• Authors of publication: Hema, R.; Parthasarathi, V.; Ravikumar, K.; Sridhar, B.; Pandiarajan, K.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 12
• Pages of publication: o4345 - o4347
• a: 12.3909 ± 0.0009 Å
• b: 11.167 ± 0.0008 Å
• c: 14.198 ± 0.001 Å
• α: 90°
• β: 100.991 ± 0.001°
• γ: 90°
• Cell volume: 1928.5 ± 0.2 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 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: 0.0473
• Residual factor for significantly intense reflections: 0.0418
• Weighted residual factors for significantly intense reflections: 0.1119
• Weighted residual factors for all reflections included in the refinement: 0.1168
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes