Information card for entry 2010272

Structure parameters

• Chemical name: 2,6-bis(dimethylamino)-3,5-diformylpyridine
• Formula: C11 H15 N3 O2
• Calculated formula: C11 H15 N3 O2
• SMILES: O=Cc1cc(C=O)c(nc1N(C)C)N(C)C
• Title of publication: 2,6-Bis(dimethylamino)-3,5-pyridine-dicarbaldehyde
• Authors of publication: Lai, Long-Li; Liu, Ling-Kang; Shiao, Ming-Jen; Wen, Yuh-Sheng
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1994
• Journal volume: 50
• Journal issue: 12
• Pages of publication: 1931 - 1933
• a: 18.316 ± 0.001 Å
• b: 8.27 ± 0.001 Å
• c: 7.438 ± 0.001 Å
• α: 90°
• β: 92.358 ± 0.003°
• γ: 90°
• Cell volume: 1125.7 ± 0.2 ų
• Cell temperature: 298 K
• Ambient diffraction temperature: 298 K
• Number of distinct elements: 4
• 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: 0.042
• Residual factor for significantly intense reflections: 0.033
• Weighted residual factors for all reflections: 0.042
• Weighted residual factors for significantly intense reflections: 0.041
• Goodness-of-fit parameter for significantly intense reflections: 2.28
• Diffraction radiation wavelength: 0.7093 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No