Information card for entry 2225433

Structure parameters

• Chemical name: 2-Amino-5-chloropyridinium trifluoroacetate
• Formula: C7 H6 Cl F3 N2 O2
• Calculated formula: C7 H6 Cl F3 N2 O2
• Title of publication: 2-Amino-5-chloropyridinium trifluoroacetate
• Authors of publication: Hemamalini, Madhukar; Fun, Hoong-Kun
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 4
• Pages of publication: o783 - o784
• a: 5.0377 ± 0.0001 Å
• b: 11.2923 ± 0.0002 Å
• c: 17.5386 ± 0.0003 Å
• α: 90°
• β: 90.001 ± 0.001°
• γ: 90°
• Cell volume: 997.72 ± 0.03 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 6
• Space group number: 7
• Hermann-Mauguin space group symbol: P 1 c 1
• Hall space group symbol: P -2yc
• Residual factor for all reflections: 0.0558
• Residual factor for significantly intense reflections: 0.036
• Weighted residual factors for significantly intense reflections: 0.0834
• Weighted residual factors for all reflections included in the refinement: 0.0939
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes