Information card for entry 1572818

Structure parameters

• Chemical name: 4-Bromo-<i>N</i>,<i>N</i>'-diphenylbenzimidamide <i>N</i>'-oxide
• Formula: C19 H15 Br N2 O
• Calculated formula: C19 H15 Br N2 O
• Title of publication: 4-Bromo-N,N′-diphenylbenzimidamide N′-oxide
• Authors of publication: Saha, Arindam; Chartrand, Daniel; Cibian, Mihaela; Maris, Thierry; Hanan, Garry S.
• Journal of publication: IUCrData
• Year of publication: 2024
• Journal volume: 9
• Journal issue: 10
• a: 17.7036 ± 0.0016 Å
• b: 5.8468 ± 0.0006 Å
• c: 31.418 ± 0.003 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3252.1 ± 0.5 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 5
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.078
• Residual factor for significantly intense reflections: 0.055
• Weighted residual factors for significantly intense reflections: 0.1396
• Weighted residual factors for all reflections included in the refinement: 0.1581
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.34139 Å
• Diffraction radiation type: GaKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No