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Information card for entry 4112309
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Coordinates | 4112309.cif |
---|---|
Original paper (by DOI) | HTML |
External links | ChemSpider |
Common name | DJM2471m |
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Formula | C15 H20 N2 O3 |
Calculated formula | C15 H20 N2 O3 |
SMILES | C(=O)(C=C(N[C@@H](c1ccccc1)C(=O)N)C(C)C)OC |
Title of publication | Highly Diastereoselective Heterogeneously Catalyzed Hydrogenation of Enamines for the Synthesis of Chiral β-Amino Acid Derivatives |
Authors of publication | Norihiro Ikemoto; David M. Tellers; Spencer D. Dreher; Jinchu Liu; Angie Huang; Nelo R. Rivera; Eugenia Njolito; Yi Hsiao; J. Christopher McWilliams; J. Michael Williams; Joseph D. Armstrong; Yongkui Sun; David J. Mathre; Edward J. J. Grabowski; Richard D. Tillyer |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2004 |
Journal volume | 126 |
Pages of publication | 3048 - 3049 |
a | 8.946 ± 0.004 Å |
b | 10 ± 0.004 Å |
c | 16.443 ± 0.007 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1471 ± 1.1 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 K |
Number of distinct elements | 4 |
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 | 0.0415 |
Residual factor for significantly intense reflections | 0.0393 |
Weighted residual factors for significantly intense reflections | 0.1044 |
Weighted residual factors for all reflections included in the refinement | 0.1061 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.077 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
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/4112309.html
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