Information card for entry 2218044

Structure parameters

• Chemical name: 2-Phenylimidazo[1,2-<i>a</i>]pyridine-3-carbaldehyde
• Formula: C14 H10 N2 O
• Calculated formula: C14 H10 N2 O
• SMILES: n1c(c(n2c1cccc2)C=O)c1ccccc1
• Title of publication: 2-Phenylimidazo[1,2-<i>a</i>]pyridine-3-carbaldehyde
• Authors of publication: Anaflous, Abderrahman; Albay, Hanane; Benchat, Nour-eddine; El Bali, Brahim; Dušek, Michal; Fejfarová, Karla
• Journal of publication: Acta Crystallographica Section E
• Year of publication: 2008
• Journal volume: 64
• Journal issue: 5
• Pages of publication: o927
• a: 13.064 ± 0.0003 Å
• b: 7.4162 ± 0.0002 Å
• c: 21.6698 ± 0.0006 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2099.48 ± 0.09 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 K
• Number of distinct elements: 4
• Space group number: 61
• Hermann-Mauguin space group symbol: P b c a
• Hall space group symbol: -P 2ac 2ab
• Residual factor for all reflections: 0.0561
• Residual factor for significantly intense reflections: 0.0314
• Weighted residual factors for significantly intense reflections: 0.0742
• Weighted residual factors for all reflections included in the refinement: 0.0773
• Goodness-of-fit parameter for all reflections included in the refinement: 1.04
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: Yes