Information card for entry 2226669

Structure parameters

• Chemical name: 2,4-Dimethylanilinium perchlorate
• Formula: C8 H12 Cl N O4
• Calculated formula: C8 H12 Cl N O4
• SMILES: Cl(=O)(=O)(=O)[O-].[NH3+]c1c(cc(cc1)C)C
• Title of publication: 2,4-Dimethylanilinium perchlorate
• Authors of publication: Liang, Wen-Xian
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 7
• Pages of publication: o1575
• a: 9.3299 ± 0.0019 Å
• b: 7.1947 ± 0.0014 Å
• c: 15.176 ± 0.003 Å
• α: 90°
• β: 97.43 ± 0.03°
• γ: 90°
• Cell volume: 1010.1 ± 0.4 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 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: 0.0526
• Residual factor for significantly intense reflections: 0.0442
• Weighted residual factors for significantly intense reflections: 0.1171
• Weighted residual factors for all reflections included in the refinement: 0.122
• Goodness-of-fit parameter for all reflections included in the refinement: 1.089
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes