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Information card for entry 1548940
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Coordinates | 1548940.cif |
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Original paper (by DOI) | HTML |
Formula | C22 H23 N O2 Si |
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Calculated formula | C22 H23 N O2 Si |
SMILES | [Si](C1C(=O)[C@@]2(C(=O)N(c3c2cccc3)C)CC=1c1ccccc1)(C)(C)C |
Title of publication | An unusual stereoretentive 1,3-quaternary carbon shift resulting in an enantioselective Rh<sup>II</sup>-catalyzed formal [4+1]-cycloaddition between diazo compounds and vinyl ketenes. |
Authors of publication | Rodriguez, Kevin X.; Pilato, Tara C.; Ashfeld, Brandon L. |
Journal of publication | Chemical science |
Year of publication | 2018 |
Journal volume | 9 |
Journal issue | 12 |
Pages of publication | 3221 - 3226 |
a | 9.4164 ± 0.0003 Å |
b | 11.6775 ± 0.0004 Å |
c | 17.207 ± 0.0006 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1892.08 ± 0.11 Å3 |
Cell temperature | 120 ± 2 K |
Ambient diffraction temperature | 120 ± 2 K |
Number of distinct elements | 5 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.0266 |
Residual factor for significantly intense reflections | 0.0266 |
Weighted residual factors for significantly intense reflections | 0.0703 |
Weighted residual factors for all reflections included in the refinement | 0.0703 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.103 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
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/1548940.html
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