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Information card for entry 2003694
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| Coordinates | 2003694.cif |
|---|---|
| Original IUCr paper | HTML |
| 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 Å3 |
| 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 |
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