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Information card for entry 4026871
Preview
Coordinates | 4026871.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C21 H34 O4 Si |
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Calculated formula | C21 H34 O4 Si |
SMILES | [Si](O[C@H]1C[C@H]([C@@]2(C(=O)[C@@]3(C(=C)COC3=O)C[C@@H]2C1)C)C)(C)(C)C(C)(C)C.[Si](O[C@@H]1C[C@@H]([C@]2(C(=O)[C@]3(C(=C)COC3=O)C[C@H]2C1)C)C)(C)(C)C(C)(C)C |
Title of publication | Stereoselective Total Synthesis of (\±)-Peribysin E |
Authors of publication | Hung-Yi Lee; Chin-Kang Sha |
Journal of publication | Journal of Organic Chemistry |
Year of publication | 2012 |
Journal volume | 77 |
Pages of publication | 598 - 605 |
a | 6.5778 ± 0.0009 Å |
b | 9.9611 ± 0.0014 Å |
c | 16.789 ± 0.002 Å |
α | 85.436 ± 0.007° |
β | 84.148 ± 0.007° |
γ | 83.784 ± 0.006° |
Cell volume | 1085.3 ± 0.2 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.1563 |
Residual factor for significantly intense reflections | 0.084 |
Weighted residual factors for significantly intense reflections | 0.2162 |
Weighted residual factors for all reflections included in the refinement | 0.2588 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.027 |
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/4026871.html
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