Information card for entry 2008671

Structure parameters

• Chemical name: 1-(4-Benzylpiperidin-1-yl)glyoxal doixime
• Formula: C14 H19 N3 O2
• Calculated formula: C14 H19 N3 O2
• SMILES: O/N=C(/N1CCC(Cc2ccccc2)CC1)\C=N\O
• Title of publication: 1-(4-Benzylpiperidin-1-yl)glyoxal dioxime
• Authors of publication: Sema Öztürk; Şamil Işık; Mustafa Macit; Hoong-Kun Fun
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1999
• Journal volume: 55
• Journal issue: 7
• Pages of publication: 1132 - 1134
• a: 17.0422 ± 0.0003 Å
• b: 13.5414 ± 0.0002 Å
• c: 13.1573 ± 0.0002 Å
• α: 90°
• β: 109.06 ± 0.001°
• γ: 90°
• Cell volume: 2869.92 ± 0.08 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: 0.059
• Residual factor for significantly intense reflections: 0.044
• Weighted residual factors for all reflections included in the refinement: 0.122
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No