Information card for entry 2201564

Structure parameters

• Common name: 2,3-lutidine
• Chemical name: 2,3-dimethylpyridine
• Formula: C7 H9 N
• Calculated formula: C7 H9 N
• SMILES: Cc1nccnc1C
• Title of publication: 2,3-Lutidine
• Authors of publication: Bond, Andrew D.; Davies, John E.
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2002
• Journal volume: 58
• Journal issue: 8
• Pages of publication: o961 - o963
• a: 11.4158 ± 0.0007 Å
• b: 7.5787 ± 0.0005 Å
• c: 7.4714 ± 0.0004 Å
• α: 90°
• β: 101.9 ± 0.004°
• γ: 90°
• Cell volume: 632.51 ± 0.07 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 3
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0678
• Residual factor for significantly intense reflections: 0.0503
• Weighted residual factors for significantly intense reflections: 0.1445
• Weighted residual factors for all reflections included in the refinement: 0.157
• Goodness-of-fit parameter for all reflections included in the refinement: 1.075
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: Yes