Information card for entry 2203407

Structure parameters

• Chemical name: anti-1-(Benzylamino)glyoxime
• Formula: C9 H11 N3 O2
• Calculated formula: C9 H11 N3 O2
• SMILES: O/N=C/C(=N/O)/NCc1ccccc1
• Title of publication: <i>anti</i>-1-(Benzylamino)glyoxime
• Authors of publication: Yavuz Köysal; Şamil Işık; Nursabah Sarıkavaklı; Fatih Erduran
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2004
• Journal volume: 60
• Journal issue: 4
• Pages of publication: o515 - o516
• a: 11.6618 ± 0.0009 Å
• b: 8.8584 ± 0.0007 Å
• c: 19.163 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1979.6 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0733
• Residual factor for significantly intense reflections: 0.0341
• Weighted residual factors for significantly intense reflections: 0.0776
• Weighted residual factors for all reflections included in the refinement: 0.0853
• Goodness-of-fit parameter for all reflections included in the refinement: 0.799
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes