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Information card for entry 2007055
Preview
| Coordinates | 2007055.cif |
|---|---|
| Original IUCr paper | HTML |
| Formula | C15 H14 F3 N O2 |
|---|---|
| Calculated formula | C15 H14 F3 N O2 |
| Title of publication | 6,7,8,9-Tetrahydro-4-trifluoromethyl-2<i>H</i>-pyrano[3,2-<i>g</i>]quinolin-2-one, (I), and 6,7,8,9-Tetrahydro-9-ethyl-4-trifluoromethyl-2<i>H</i>-pyrano[3,2-<i>g</i>]quinolin-2-one, (II) |
| Authors of publication | Jasinski, Jerry P.; Jasinski, John M.; Li, Yu |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 1998 |
| Journal volume | 54 |
| Journal issue | 3 |
| Pages of publication | 410 - 412 |
| a | 9.756 ± 0.004 Å |
| b | 12.613 ± 0.004 Å |
| c | 22.443 ± 0.004 Å |
| α | 90° |
| β | 92.45 ± 0.02° |
| γ | 90° |
| Cell volume | 2759.1 ± 1.5 Å3 |
| Cell temperature | 296 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.162 |
| Residual factor for significantly intense reflections | 0.055 |
| Weighted residual factors for all reflections | 0.184 |
| Weighted residual factors for significantly intense reflections | 0.127 |
| Goodness-of-fit parameter for all reflections | 1 |
| Goodness-of-fit parameter for significantly intense reflections | 1.17 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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