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Information card for entry 4122667
Preview
Coordinates | 4122667.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C30 H29 N Si |
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Calculated formula | C30 H29 N Si |
SMILES | [Si](C1N(CCC1)/C=C/c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1 |
Title of publication | Structures and Reactivities of 2-Trityl- and 2-(Triphenylsilyl)pyrrolidine-Derived Enamines: Evidence for Negative Hyperconjugation with the Trityl Group. |
Authors of publication | Erdmann, Hannes; An, Feng; Mayer, Peter; Ofial, Armin R.; Lakhdar, Sami; Mayr, Herbert |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2014 |
Journal volume | 136 |
Journal issue | 40 |
Pages of publication | 14263 |
a | 9.8402 ± 0.0004 Å |
b | 8.4762 ± 0.0004 Å |
c | 28.5374 ± 0.0012 Å |
α | 90° |
β | 92.7937 ± 0.0012° |
γ | 90° |
Cell volume | 2377.4 ± 0.18 Å3 |
Cell temperature | 200 ± 2 K |
Ambient diffraction temperature | 200 ± 2 K |
Number of distinct elements | 4 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0421 |
Residual factor for significantly intense reflections | 0.0348 |
Weighted residual factors for significantly intense reflections | 0.0878 |
Weighted residual factors for all reflections included in the refinement | 0.0926 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.06 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4122667.html
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