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Information card for entry 7151812
Preview
| Coordinates | 7151812.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C42 H49 N O3 Si |
|---|---|
| Calculated formula | C42 H49 N O3 Si |
| SMILES | C(C)(C)(C)[Si](c1ccccc1)(c1ccccc1)O[C@@H]1CC[C@]23CCC=C[C@@H]([C@H]([C@@H]12)[C@H](CC3)C)OC(=O)Nc1cccc2ccccc12.C(C)(C)(C)[Si](c1ccccc1)(c1ccccc1)O[C@H]1CC[C@@]23CCC=C[C@H]([C@@H]([C@H]12)[C@@H](CC3)C)OC(=O)Nc1cccc2ccccc12 |
| Title of publication | A stereoselective, Sm(II)-mediated approach to decorated cis-hydrindanes: synthetic studies on faurinone and pleuromutilin. |
| Authors of publication | Findley, Thomas J. K.; Sucunza, David; Miller, Laura C.; Helm, Matthew D.; Helliwell, Madeleine; Davies, David T.; Procter, David J. |
| Journal of publication | Organic & biomolecular chemistry |
| Year of publication | 2011 |
| Journal volume | 9 |
| Journal issue | 7 |
| Pages of publication | 2433 - 2451 |
| a | 10.4285 ± 0.0015 Å |
| b | 12.4428 ± 0.0015 Å |
| c | 14.7188 ± 0.0015 Å |
| α | 86.41 ± 0.003° |
| β | 72.131 ± 0.002° |
| γ | 86.886 ± 0.003° |
| Cell volume | 1813 ± 0.4 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 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 | 0.2302 |
| Residual factor for significantly intense reflections | 0.0756 |
| Weighted residual factors for significantly intense reflections | 0.1387 |
| Weighted residual factors for all reflections included in the refinement | 0.1795 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.775 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 180304 (current) | 2016-03-26 | cif/7/15/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/15/18. |
7151812.cif |
| 120443 | 2014-07-15 | Adding 17924 DOIs guessed from source file names. | 7151812.cif |
| 35909 | 2012-02-26 | cif/7/: reorganising range 7 into a prefix-directory tree. | 7151812.cif |
| 21276 | 2011-06-22 | ../uploads/cif-deposit/cod/cif Adding structures of 7151812 via cif-deposit CGI script. |
7151812.cif |
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