Information card for entry 1567246

Structure parameters

• Common name: 5-Chloroisatin-3-oxime
• Chemical name: (3<i>Z</i>)-5-Chloro-3-(hydroxyimino)indolin-2-one
• Formula: C8 H5 Cl N2 O2
• Calculated formula: C8 H5 Cl N2 O2
• Title of publication: (3Z)-5-Chloro-3-(hydroxyimino)indolin-2-one
• Authors of publication: Martins, Bianca Barreto; Gervini, Vanessa Carratu; Pires, Fabricio Carvalho; Bortoluzzi, Adailton João; de Oliveira, Adriano Bof
• Journal of publication: IUCrData
• Year of publication: 2016
• Journal volume: 1
• Journal issue: 10
• Pages of publication: x161506
• a: 7.4296 ± 0.0003 Å
• b: 7.5187 ± 0.0003 Å
• c: 14.3206 ± 0.0007 Å
• α: 90°
• β: 94.184 ± 0.001°
• γ: 90°
• Cell volume: 797.83 ± 0.06 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• 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: 0.0372
• Residual factor for significantly intense reflections: 0.032
• Weighted residual factors for significantly intense reflections: 0.0902
• Weighted residual factors for all reflections included in the refinement: 0.0953
• Goodness-of-fit parameter for all reflections included in the refinement: 1.052
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes