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Information card for entry 7156192
Preview
| Coordinates | 7156192.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C22 H29 F N2 O4 |
|---|---|
| Calculated formula | C22 H29 F N2 O4 |
| Title of publication | Realisation of small molecule libraries based on frameworks distantly related to natural products. |
| Authors of publication | Aimon, Anthony; Karageorgis, George; Masters, Jacob; Dow, Mark; Craven, Philip G. E.; Ohsten, Martin; Willaume, Anthony; Morgentin, Rémy; Ruiz-Llamas, Nicolas; Lemoine, Hugues; Kalliokoski, Tuomo; Eatherton, Andrew J.; Foley, Daniel J.; Marsden, Stephen P.; Nelson, Adam |
| Journal of publication | Organic & biomolecular chemistry |
| Year of publication | 2018 |
| Journal volume | 16 |
| Journal issue | 17 |
| Pages of publication | 3160 - 3167 |
| a | 10.7014 ± 0.0002 Å |
| b | 14.4421 ± 0.0003 Å |
| c | 14.1016 ± 0.0004 Å |
| α | 90° |
| β | 106.984 ± 0.003° |
| γ | 90° |
| Cell volume | 2084.36 ± 0.09 Å3 |
| Cell temperature | 119.99 ± 0.17 K |
| Ambient diffraction temperature | 119.99 ± 0.17 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.045 |
| Residual factor for significantly intense reflections | 0.0392 |
| Weighted residual factors for significantly intense reflections | 0.0939 |
| Weighted residual factors for all reflections included in the refinement | 0.0988 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.053 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 230711 (current) | 2019-11-17 | cif/ Updating files of 7156192 Original log message: Adding full bibliography for 7156192.cif. |
7156192.cif |
| 207313 | 2018-04-12 | cif/ Adding structures of 7156192 via cif-deposit CGI script. |
7156192.cif |
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.
Users of the data should acknowledge the original authors of the
structural data.