Information card for entry 2227347

Structure parameters

• Common name: Salicylaldehyde‒4-(dimethylamino)pyridine (1/1)
• Chemical name: 2-Hydroxybenzaldehyde‒4-(dimethylamino)pyridine (1/1)
• Formula: C14 H16 N2 O2
• Calculated formula: C14 H16 N2 O2
• SMILES: c1cc(ccn1)N(C)C.c1(ccccc1O)C=O
• Title of publication: Salicylaldehyde‒4-(dimethylamino)pyridine (1/1)
• Authors of publication: Phurat, Chuttree; Teerawatananond, Thapong; Muangsin, Nongnuj
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2010
• Journal volume: 66
• Journal issue: 9
• Pages of publication: o2423
• a: 7.54 ± 0.003 Å
• b: 8.473 ± 0.003 Å
• c: 10.413 ± 0.004 Å
• α: 85.37 ± 0.011°
• β: 77.371 ± 0.01°
• γ: 87.203 ± 0.01°
• Cell volume: 646.7 ± 0.4 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0489
• Weighted residual factors for all reflections included in the refinement: 0.1631
• Goodness-of-fit parameter for all reflections included in the refinement: 1.01
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes