Information card for entry 2206089

Structure parameters

• Common name: (4-pyridylmethyl)ammonium chloride
• Chemical name: (4-Pyridylmethyl)aminium chloride
• Formula: C6 H9 Cl N2
• Calculated formula: C6 H9 Cl N2
• SMILES: n1ccc(cc1)C[NH3+].[Cl-]
• Title of publication: (4-Pyridylmethyl)aminium chloride
• Authors of publication: Elise J. C. de Vries; Clive L. Oliver; Gareth O. Lloyd
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2005
• Journal volume: 61
• Journal issue: 6
• Pages of publication: o1577 - o1578
• a: 7.8401 ± 0.0009 Å
• b: 12.5177 ± 0.0014 Å
• c: 7.6177 ± 0.0008 Å
• α: 90°
• β: 103.049 ± 0.002°
• γ: 90°
• Cell volume: 728.3 ± 0.14 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• 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: 0.0402
• Residual factor for significantly intense reflections: 0.0356
• Weighted residual factors for significantly intense reflections: 0.087
• Weighted residual factors for all reflections included in the refinement: 0.0898
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes