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Information card for entry 1545229
Preview
| Coordinates | 1545229.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C25 H35 N O2 S Si |
|---|---|
| Calculated formula | C25 H35 N O2 S Si |
| SMILES | C(=C(\c1ccccc1)[SiH](CC)CC)/N(C1CCCCC1)S(=O)(=O)c1ccc(C)cc1 |
| Title of publication | Borane-Catalyzed Selective Hydrosilylation of Internal Ynamides Leading to β-Silyl (Z)-Enamides. |
| Authors of publication | Kim, Youngchan; Dateer, Ramesh B.; Chang, Sukbok |
| Journal of publication | Organic letters |
| Year of publication | 2017 |
| Journal volume | 19 |
| Journal issue | 1 |
| Pages of publication | 190 - 193 |
| a | 9.9367 ± 0.0005 Å |
| b | 11.6098 ± 0.0006 Å |
| c | 12.8011 ± 0.0006 Å |
| α | 104.929 ± 0.002° |
| β | 105.574 ± 0.002° |
| γ | 111.041 ± 0.002° |
| Cell volume | 1220.44 ± 0.11 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0513 |
| Residual factor for significantly intense reflections | 0.0388 |
| Weighted residual factors for significantly intense reflections | 0.0935 |
| Weighted residual factors for all reflections included in the refinement | 0.1003 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.953 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 191321 (current) | 2017-02-04 | cif/ Adding structures of 1545229 via cif-deposit CGI script. |
1545229.cif |
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