Information card for entry 2219604

Structure parameters

• Common name: no
• Chemical name: (2-Aminophenyl)methyldiphenylphosphonium iodide
• Formula: C19 H19 I N P
• Calculated formula: C19 H19 I N P
• SMILES: [I-].[P+](c1ccccc1N)(c1ccccc1)(c1ccccc1)C
• Title of publication: (2-Aminophenyl)methyldiphenylphosphonium iodide
• Authors of publication: Li, Zhongshui; Zhu, Meipin; Li, Aike; Chen, Jianxin; Zhang, Li
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 10
• Pages of publication: o2016
• a: 13.215 ± 0.004 Å
• b: 17.854 ± 0.004 Å
• c: 15.325 ± 0.006 Å
• α: 90°
• β: 93.385 ± 0.014°
• γ: 90°
• Cell volume: 3609 ± 2 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 5
• 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: 0.0409
• Residual factor for significantly intense reflections: 0.0302
• Weighted residual factors for significantly intense reflections: 0.0684
• Weighted residual factors for all reflections included in the refinement: 0.0711
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes