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Information card for entry 4123301
Preview
Coordinates | 4123301.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C19 H26 O4 |
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Calculated formula | C19 H26 O4 |
SMILES | O(C)C(=O)C[C@@H](C1CCCCC1)[C@@H](c1ccccc1)C(=O)OC |
Title of publication | Direct enantioselective conjugate addition of carboxylic acids with chiral lithium amides as traceless auxiliaries. |
Authors of publication | Lu, Ping; Jackson, Jeffrey J.; Eickhoff, John A.; Zakarian, Armen |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2015 |
Journal volume | 137 |
Journal issue | 2 |
Pages of publication | 656 - 659 |
a | 8.7984 ± 0.0006 Å |
b | 10.1655 ± 0.0008 Å |
c | 9.8954 ± 0.0007 Å |
α | 90° |
β | 90.989 ± 0.002° |
γ | 90° |
Cell volume | 884.91 ± 0.11 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 3 |
Space group number | 4 |
Hermann-Mauguin space group symbol | P 1 21 1 |
Hall space group symbol | P 2yb |
Residual factor for all reflections | 0.039 |
Residual factor for significantly intense reflections | 0.0385 |
Weighted residual factors for significantly intense reflections | 0.1086 |
Weighted residual factors for all reflections included in the refinement | 0.1094 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.066 |
Diffraction radiation wavelength | 1.54178 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/4123301.html
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