Information card for entry 2201039

Structure parameters

• Common name: 2,4-lutidine
• Chemical name: 2,4-dimethylpyridine
• Formula: C7 H9 N
• Calculated formula: C7 H9 N
• SMILES: n1c(cc(cc1)C)C
• Title of publication: 2,4-Lutidine
• Authors of publication: Bond, Andrew D.; Parsons, Simon
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 5
• Pages of publication: o550 - o552
• a: 7.4247 ± 0.0008 Å
• b: 10.9401 ± 0.0012 Å
• c: 8.2473 ± 0.0009 Å
• α: 90°
• β: 107.342 ± 0.002°
• γ: 90°
• Cell volume: 639.45 ± 0.12 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 3
• 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: 0.0655
• Residual factor for significantly intense reflections: 0.0546
• Weighted residual factors for significantly intense reflections: 0.1398
• Weighted residual factors for all reflections included in the refinement: 0.1462
• Goodness-of-fit parameter for all reflections included in the refinement: 0.944
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes