Information card for entry 1550130

Structure parameters

• Common name: 2-Amino-5-chlorobenzophenone
• Chemical name: 2-Benzoyl-4-chloroaniline
• Formula: C13 H10 Cl N O
• Calculated formula: C13 H10 Cl N O
• SMILES: Clc1cc(c(N)cc1)C(=O)c1ccccc1
• Title of publication: 2-Amino-5-chlorobenzophenone
• Authors of publication: Javed, Saleem; Faizi, Md. Serajul Haque; Nazia, Siddiqui; Iskenderov, Turganbay
• Journal of publication: IUCrData
• Year of publication: 2018
• Journal volume: 3
• Journal issue: 10
• Pages of publication: x181444
• a: 9.7335 ± 0.0007 Å
• b: 10.6473 ± 0.0007 Å
• c: 24.7554 ± 0.0017 Å
• α: 87.443 ± 0.002°
• β: 84.272 ± 0.002°
• γ: 62.978 ± 0.002°
• Cell volume: 2274.1 ± 0.3 ų
• Cell temperature: 273 ± 2 K
• Ambient diffraction temperature: 273 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.2229
• Residual factor for significantly intense reflections: 0.0799
• Weighted residual factors for significantly intense reflections: 0.1813
• Weighted residual factors for all reflections included in the refinement: 0.2252
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes