Information card for entry 8104897

Structure parameters

• Chemical name: Phenarsazine chloride acetic acid solvate
• Formula: C14 H13 As Cl N O2
• Calculated formula: C14 H13 As Cl N O2
• Title of publication: Crystal structure of phenarsazine chloride acetic acid solvate, C14H13AsClNO2
• Authors of publication: Averdunk, Arthur; Hosten, Eric C.; Betz, Richard
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2021
• Journal volume: 236
• Journal issue: 1
• Pages of publication: 113 - 115
• a: 7.718 ± 0.0007 Å
• b: 8.219 ± 0.0007 Å
• c: 11.962 ± 0.001 Å
• α: 87.438 ± 0.004°
• β: 73.45 ± 0.004°
• γ: 72.167 ± 0.004°
• Cell volume: 691.66 ± 0.11 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0239
• Residual factor for significantly intense reflections: 0.0203
• Weighted residual factors for significantly intense reflections: 0.0524
• Weighted residual factors for all reflections included in the refinement: 0.0541
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No