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Information card for entry 4131744
Preview
| Coordinates | 4131744.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C26 H42 O3 Si |
|---|---|
| Calculated formula | C26 H42 O3 Si |
| Title of publication | Development of a Modular Synthetic Route to (+)-Pleuromutilin, (+)-12-epi-Mutilins, and Related Structures. |
| Authors of publication | Zeng, Mingshuo; Murphy, Stephen K.; Herzon, Seth B. |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2017 |
| Journal volume | 139 |
| Journal issue | 45 |
| Pages of publication | 16377 - 16388 |
| a | 17.4551 ± 0.0002 Å |
| b | 25.0058 ± 0.0003 Å |
| c | 33.3734 ± 0.0003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 14566.8 ± 0.3 Å3 |
| Cell temperature | 93 ± 2 K |
| Ambient diffraction temperature | 93 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0389 |
| Residual factor for significantly intense reflections | 0.0364 |
| Weighted residual factors for significantly intense reflections | 0.0894 |
| Weighted residual factors for all reflections included in the refinement | 0.0912 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.016 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 241913 (current) | 2019-11-25 | cif/ Adding structures of 4131744 via cif-deposit CGI script. |
4131744.cif |
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Users of the data should acknowledge the original authors of the
structural data.