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Information card for entry 4024052
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Coordinates | 4024052.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | amine addition |
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Chemical name | 4-(2-(benzyl(methyl)amino)propan-2-yl)oxazolidin-2-one |
Formula | C14 H20 N2 O2 |
Calculated formula | C14 H20 N2 O2 |
SMILES | c1(ccccc1)CN(C)C(C)(C)C1NC(=O)OC1 |
Title of publication | Copper-Catalyzed Tethered Aziridination of Unsaturated N-Tosyloxy Carbamates |
Authors of publication | Renmao Liu; Steven R. Herron; Steven A. Fleming |
Journal of publication | Journal of Organic Chemistry |
Year of publication | 2007 |
Journal volume | 72 |
Pages of publication | 5587 - 5591 |
a | 6.8765 ± 0.0013 Å |
b | 7.0185 ± 0.0013 Å |
c | 28.58 ± 0.005 Å |
α | 90° |
β | 92.844 ± 0.002° |
γ | 90° |
Cell volume | 1377.6 ± 0.4 Å3 |
Cell temperature | 273 ± 2 K |
Ambient diffraction temperature | 273 ± 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 | 0.1055 |
Residual factor for significantly intense reflections | 0.0747 |
Weighted residual factors for significantly intense reflections | 0.1963 |
Weighted residual factors for all reflections included in the refinement | 0.2261 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.056 |
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/4024052.html
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