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Information card for entry 2008170
Preview
| Coordinates | 2008170.cif |
|---|---|
| Original IUCr paper | HTML |
| Formula | C20 H12 N2 O4 |
|---|---|
| Calculated formula | C20 H12 N2 O4 |
| SMILES | c1(ccccc1/C=N/c1c(c(c(c2ccco2)o1)c1ccco1)C#N)O |
| Title of publication | 2-Salicylideneamino-4,5-bis(2-furyl)furan-3-carbonitrile |
| Authors of publication | Elmali, Ayhan; Kabak, Mehmet; Elerman, Yalc̨in |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 1999 |
| Journal volume | 55 |
| Journal issue | 2 |
| Pages of publication | 258 - 260 |
| a | 9.024 ± 0.003 Å |
| b | 11.442 ± 0.002 Å |
| c | 17.506 ± 0.003 Å |
| α | 86.12 ± 0.01° |
| β | 79.1 ± 0.02° |
| γ | 68.33 ± 0.02° |
| Cell volume | 1649.5 ± 0.7 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 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 all reflections | 0.0773 |
| Residual factor for significantly intense reflections | 0.0467 |
| Weighted residual factors for all reflections | 0.1618 |
| Weighted residual factors for significantly intense reflections | 0.1162 |
| Goodness-of-fit parameter for all reflections | 1.092 |
| Goodness-of-fit parameter for significantly intense reflections | 0.987 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
Version history
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Users of the data should acknowledge the original authors of the
structural data.