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Information card for entry 1516586
Preview
| Coordinates | 1516586.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C34 H45 Br N2 O6 Si |
|---|---|
| Calculated formula | C34 H45 Br N2 O6 Si |
| SMILES | Brc1cc(N(=O)=O)c([C@](C(=O)OCC=C)(CC=C)[C@@]2(c3ccccc3N(C2=O)C)CCO[Si](C(C)C)(C(C)C)C(C)C)cc1.Brc1cc(N(=O)=O)c([C@@](C(=O)OCC=C)(CC=C)[C@]2(c3ccccc3N(C2=O)C)CCO[Si](C(C)C)(C(C)C)C(C)C)cc1 |
| Title of publication | A diastereodivergent synthetic strategy for the syntheses of communesin f and perophoramidine. |
| Authors of publication | Han, Seo-Jung; Vogt, Florian; Krishnan, Shyam; May, Jeremy A.; Gatti, Michele; Virgil, Scott C.; Stoltz, Brian M. |
| Journal of publication | Organic letters |
| Year of publication | 2014 |
| Journal volume | 16 |
| Journal issue | 12 |
| Pages of publication | 3316 - 3319 |
| a | 8.0482 ± 0.0004 Å |
| b | 14.1277 ± 0.0008 Å |
| c | 15.3665 ± 0.0008 Å |
| α | 99.073 ± 0.002° |
| β | 94.101 ± 0.003° |
| γ | 91.448 ± 0.002° |
| Cell volume | 1719.75 ± 0.16 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 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 | 0.0754 |
| Residual factor for significantly intense reflections | 0.0402 |
| Weighted residual factors for significantly intense reflections | 0.0805 |
| Weighted residual factors for all reflections included in the refinement | 0.0892 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.117 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176729 (current) | 2016-02-18 | cif/ (antanas@echidna.ibt.lt) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 1. |
1516586.cif |
| 119300 | 2014-07-05 | cif/ Updating files of 1516586, 1516587 Original log message: Adding full bibliography for 1516586--1516587.cif. |
1516586.cif |
| 116342 | 2014-06-10 | cif/ Adding structures of 1516586 via cif-deposit CGI script. |
1516586.cif |
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Users of the data should acknowledge the original authors of the
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