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Information card for entry 4025557
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Coordinates | 4025557.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | (R*)-5-((3R*,4R*)-4-(tert-butyldimethylsilyloxy)- 3-methyltetrahydro-2H-thiopyran-4-yl)furan-2(5H)-one |
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Formula | C16 H28 O3 S Si |
Calculated formula | C16 H28 O3 S Si |
Title of publication | Carbon Acid Induced Mukaiyama Aldol Type Reaction of Sterically Hindered Ketones |
Authors of publication | Hikaru Yanai; Yasuhiro Yoshino; Arata Takahashi; Takeo Taguchi |
Journal of publication | Journal of Organic Chemistry |
Year of publication | 2010 |
Journal volume | 75 |
Pages of publication | 5375 - 5378 |
a | 7.8568 ± 0.0009 Å |
b | 9.3124 ± 0.001 Å |
c | 12.7551 ± 0.0014 Å |
α | 95.564 ± 0.001° |
β | 92.993 ± 0.001° |
γ | 99.913 ± 0.001° |
Cell volume | 912.71 ± 0.17 Å3 |
Cell temperature | 90 K |
Ambient diffraction temperature | 90 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 | 0.0423 |
Residual factor for significantly intense reflections | 0.0348 |
Weighted residual factors for significantly intense reflections | 0.0871 |
Weighted residual factors for all reflections included in the refinement | 0.0906 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.066 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | Yes |
Has Fobs | No |
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