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Information card for entry 2000502
Preview
| Coordinates | 2000502.cif |
|---|---|
| Original IUCr paper | HTML |
| Formula | C26 H24 N4 O4 |
|---|---|
| Calculated formula | C26 H23 N4 O4 |
| SMILES | O(c1cc2cccnc2cc1)c1cc2cccnc2cc1.O=C1NC(=O)NC(=O)C1(CC)CC |
| Title of publication | Structure of the 1:1 complex of 6,6'-diquinolyl ether with 5,5-diethylbarbituric acid |
| Authors of publication | Liu, H.; Wang, X.; Zhang, X. |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 1992 |
| Journal volume | 48 |
| Journal issue | 11 |
| Pages of publication | 2096 - 2098 |
| a | 24.565 ± 0.002 Å |
| b | 17.75 ± 0.002 Å |
| c | 10.959 ± 0.003 Å |
| α | 90° |
| β | 105.24 ± 0.03° |
| γ | 90° |
| Cell volume | 4610.4 ± 1.6 Å3 |
| Cell temperature | 294 K |
| Number of distinct elements | 4 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Residual factor for significantly intense reflections | 0.052 |
| Weighted residual factors for significantly intense reflections | 0.047 |
| Goodness-of-fit parameter for significantly intense reflections | 3.75 |
| Diffraction radiation wavelength | 0.7107 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.