Information card for entry 2207463
Chemical name |
(3S,1S)-1-tert-Butyldiphenylsiloxy-3-hydroxy-3-isopropenyl-1,2,3,4- tetrahydronaphthalene |
Formula |
C29 H34 O2 Si |
Calculated formula |
C29 H34 O2 Si |
SMILES |
[Si](O[C@H]1C[C@@](O)(Cc2ccccc12)C(=C)C)(C(C)(C)C)(c1ccccc1)c1ccccc1 |
Title of publication |
(1<i>S</i>,3<i>S</i>)-1-<i>tert</i>-Butyldiphenylsiloxy-3-hydroxy-3-isopropenyl-1,2,3,4-tetrahydronaphthalene |
Authors of publication |
Fan, Eric; Lowary, Todd L.; Ferguson, Michael J. |
Journal of publication |
Acta Crystallographica Section E |
Year of publication |
2005 |
Journal volume |
61 |
Journal issue |
12 |
Pages of publication |
o4295 - o4297 |
a |
10.4483 ± 0.0012 Å |
b |
10.2152 ± 0.0012 Å |
c |
11.6877 ± 0.0013 Å |
α |
90° |
β |
94.506 ± 0.002° |
γ |
90° |
Cell volume |
1243.6 ± 0.2 Å3 |
Cell temperature |
193 ± 2 K |
Ambient diffraction temperature |
193 ± 2 K |
Number of distinct elements |
4 |
Space group number |
4 |
Hermann-Mauguin space group symbol |
P 1 21 1 |
Hall space group symbol |
P 2yb |
Residual factor for all reflections |
0.0458 |
Residual factor for significantly intense reflections |
0.0382 |
Weighted residual factors for significantly intense reflections |
0.0915 |
Weighted residual factors for all reflections included in the refinement |
0.0951 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.045 |
Diffraction radiation wavelength |
0.71073 Å |
Diffraction radiation type |
MoKα |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
Yes |
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https://www.crystallography.net/2207463.html