Information card for entry 2022873

Structure parameters

• Chemical name: Dibenzylammonium hydrogen (4-aminophenyl)arsonate monohydrate
• Formula: C20 H25 As N2 O4
• Calculated formula: C20 H24.88 As N2 O4
• Title of publication: Crystal structure of di-benzyl-ammonium hydrogen (4-amino-phen-yl)arsonate monohydrate.
• Authors of publication: Traoré, Bocar; Diallo, Waly; Sidibé, Mamadou; Diop, Libasse; Plasseraud, Laurent; Cattey, Hélène
• Journal of publication: Acta crystallographica. Section E, Crystallographic communications
• Year of publication: 2023
• Journal volume: 79
• Journal issue: Pt 11
• Pages of publication: 1003 - 1007
• a: 9.8242 ± 0.0005 Å
• b: 10.6574 ± 0.0006 Å
• c: 19.2507 ± 0.0011 Å
• α: 90°
• β: 97.75 ± 0.0018°
• γ: 90°
• Cell volume: 1997.15 ± 0.19 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 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: 0.0272
• Residual factor for significantly intense reflections: 0.0219
• Weighted residual factors for significantly intense reflections: 0.0512
• Weighted residual factors for all reflections included in the refinement: 0.054
• Goodness-of-fit parameter for all reflections included in the refinement: 1.066
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes