Information card for entry 2003694

Structure parameters

• Chemical name: 2,2'-Oxybispyridine
• Formula: C10 H8 N2 O
• Calculated formula: C10 H8 N2 O
• SMILES: c1ccc(nc1)Oc1ccccn1
• Title of publication: 2,2'-Oxybispyridine and 2,2'-Selenobispyridine
• Authors of publication: Dunne, S. J.; von Nagy-Felsobuki, E. I.; Mackay, M. F.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 7
• Pages of publication: 1454 - 1457
• a: 8.651 ± 0.002 Å
• b: 11.534 ± 0.003 Å
• c: 8.878 ± 0.003 Å
• α: 90°
• β: 93.6 ± 0.02°
• γ: 90°
• Cell volume: 884.1 ± 0.4 ų
• Cell temperature: 291 ± 1 K
• Ambient diffraction temperature: 291 ± 1 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for significantly intense reflections: 0.057
• Weighted residual factors for significantly intense reflections: 0.075
• Goodness-of-fit parameter for significantly intense reflections: 1.52
• Diffraction radiation wavelength: 1.5418 Å
• Diffraction radiation type: CopperKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No