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Information card for entry 4106929
Preview
Coordinates | 4106929.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C11 H21 Br O3 |
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Calculated formula | C11 H21 Br O3 |
SMILES | Br[C@@H](CC)[C@H]1O[C@H](C)C[C@H](O)[C@H](O)CC1.Br[C@H](CC)[C@@H]1O[C@@H](C)C[C@@H](O)[C@@H](O)CC1 |
Title of publication | A General Strategy for the Stereocontrolled Preparation of Diverse 8- and 9-Membered Laurencia-Type Bromoethers |
Authors of publication | Scott A. Snyder; Daniel S. Treitler; Alexandria P. Brucks; Wesley Sattler |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2011 |
Journal volume | 133 |
Pages of publication | 15898 - 15901 |
a | 18.661 ± 0.003 Å |
b | 8.7754 ± 0.0016 Å |
c | 7.9279 ± 0.0015 Å |
α | 90° |
β | 96.648 ± 0.003° |
γ | 90° |
Cell volume | 1289.5 ± 0.4 Å3 |
Cell temperature | 150 ± 2 K |
Ambient diffraction temperature | 150 ± 2 K |
Number of distinct elements | 4 |
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 | 0.0965 |
Residual factor for significantly intense reflections | 0.044 |
Weighted residual factors for significantly intense reflections | 0.083 |
Weighted residual factors for all reflections included in the refinement | 0.0974 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.026 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/4106929.html
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