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Information card for entry 1548984
Preview
| Coordinates | 1548984.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C15 H10 B5 F30 K5 |
|---|---|
| Calculated formula | C15 H10 B5 F30 K5 |
| Title of publication | Rapid access to diverse, trifluoromethyl-substituted alkenes using complementary strategies. |
| Authors of publication | Phelan, James P.; Wiles, Rebecca J.; Lang, Simon B.; Kelly, Christopher B.; Molander, Gary A. |
| Journal of publication | Chemical science |
| Year of publication | 2018 |
| Journal volume | 9 |
| Journal issue | 12 |
| Pages of publication | 3215 - 3220 |
| a | 10.9621 ± 0.0004 Å |
| b | 12.9672 ± 0.0005 Å |
| c | 13.9252 ± 0.0005 Å |
| α | 111.325 ± 0.002° |
| β | 99.442 ± 0.002° |
| γ | 105.532 ± 0.002° |
| Cell volume | 1699.54 ± 0.12 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.032 |
| Residual factor for significantly intense reflections | 0.0283 |
| Weighted residual factors for significantly intense reflections | 0.068 |
| Weighted residual factors for all reflections included in the refinement | 0.0704 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.081 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 228863 (current) | 2019-11-17 | cif/ Updating files of 1548984 Original log message: Adding full bibliography for 1548984.cif. |
1548984.cif |
| 206604 | 2018-02-23 | cif/ Adding structures of 1548984 via cif-deposit CGI script. |
1548984.cif |
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Users of the data should acknowledge the original authors of the
structural data.