Information card for entry 2202168

Structure parameters

• Chemical name: N-para-bromophenyl-N'-2-chlorobenzoylurea
• Formula: C14 H10 Br Cl N2 O2
• Calculated formula: C14 H10 Br Cl N2 O2
• SMILES: Brc1ccc(NC(=O)NC(=O)c2ccccc2Cl)cc1
• Title of publication: <i>N</i>-<i>p</i>-Bromophenyl-<i>N</i>'-(2-chlorobenzoyl)urea
• Authors of publication: Bohari M. Yamin; A. Sahali Mardi
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2003
• Journal volume: 59
• Journal issue: 4
• Pages of publication: o399 - o400
• a: 7.6761 ± 0.0007 Å
• b: 17.752 ± 0.0017 Å
• c: 10.3654 ± 0.001 Å
• α: 90°
• β: 105.479 ± 0.002°
• γ: 90°
• Cell volume: 1361.2 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.054
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for significantly intense reflections: 0.09
• Weighted residual factors for all reflections included in the refinement: 0.098
• Goodness-of-fit parameter for all reflections included in the refinement: 1.02
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes