Information card for entry 2209495

Structure parameters

• Chemical name: 4-Methylbenzamidoxime
• Formula: C8 H10 N2 O
• Calculated formula: C8 H10 N2 O
• SMILES: ON=C(N)c1ccc(C)cc1
• Title of publication: 4-Methylbenzamide oxime
• Authors of publication: Wang, Hai-Bo; Yan, Xiao-Chen; Liu, Zhi-Qian
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2006
• Journal volume: 62
• Journal issue: 7
• Pages of publication: o3105 - o3106
• a: 6.422 ± 0.0013 Å
• b: 7.472 ± 0.0015 Å
• c: 17.181 ± 0.003 Å
• α: 79.48 ± 0.03°
• β: 82.16 ± 0.03°
• γ: 85.45 ± 0.03°
• Cell volume: 801.7 ± 0.3 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0862
• Residual factor for significantly intense reflections: 0.0594
• Weighted residual factors for significantly intense reflections: 0.1663
• Weighted residual factors for all reflections included in the refinement: 0.1862
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes