Information card for entry 1572954

Structure parameters

• Chemical name: 2-Chloro-<i>N</i>-(4-hydroxyphenyl)acetamide
• Formula: C8 H8 Cl N O2
• Calculated formula: C8 H8 Cl N O2
• SMILES: c1(ccc(cc1)NC(=O)CCl)O
• Authors of publication: El Moutaouakil Ala Allah, Abderrazzak; Kariuki, Benson M.; Ameziane El Hassani, Issam; Alsubari, Abdulsalam; Guerrab, Walid; A. Said, Musa; Ramli, Youssef
• Journal of publication: IUCrData
• Year of publication: 2024
• Journal volume: 9
• Journal issue: 10
• Pages of publication: x241015
• a: 6.5088 ± 0.0006 Å
• b: 5.1758 ± 0.0005 Å
• c: 12.2175 ± 0.0014 Å
• α: 90°
• β: 101.649 ± 0.01°
• γ: 90°
• Cell volume: 403.11 ± 0.07 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 5
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.06
• Residual factor for significantly intense reflections: 0.039
• Weighted residual factors for significantly intense reflections: 0.0694
• Weighted residual factors for all reflections included in the refinement: 0.0809
• Goodness-of-fit parameter for all reflections included in the refinement: 1.061
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No