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Information card for entry 4114266
Preview
Coordinates | 4114266.cif |
---|---|
Original paper (by DOI) | HTML |
Common name | 03081vv |
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Formula | C14 H19 N O4 |
Calculated formula | C14 H19 N O4 |
SMILES | N1([C@@H]2[C@@]3(O[C@@H](C=C3)CC2=O)CC1)C(=O)OC(C)(C)C.N1([C@H]2[C@]3(O[C@H](C=C3)CC2=O)CC1)C(=O)OC(C)(C)C |
Title of publication | Stereoselective Intramolecular [4 + 3] Cycloadditions of Nitrogen-Stabilized Chiral Oxyallyl Cations via Epoxidation of N-Tethered Allenamides |
Authors of publication | Hui Xiong; Jian Huang; Sunil K. Ghosh; Richard P. Hsung |
Journal of publication | Journal of the American Chemical Society |
Year of publication | 2003 |
Journal volume | 125 |
Pages of publication | 12694 - 12695 |
a | 10.9417 ± 0.0008 Å |
b | 10.7162 ± 0.0008 Å |
c | 11.6477 ± 0.0009 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1365.73 ± 0.18 Å3 |
Cell temperature | 173 ± 2 K |
Ambient diffraction temperature | 173 ± 2 K |
Number of distinct elements | 4 |
Space group number | 33 |
Hermann-Mauguin space group symbol | P n a 21 |
Hall space group symbol | P 2c -2n |
Residual factor for all reflections | 0.034 |
Residual factor for significantly intense reflections | 0.0327 |
Weighted residual factors for significantly intense reflections | 0.0873 |
Weighted residual factors for all reflections included in the refinement | 0.0888 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.041 |
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/4114266.html
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Users of the data should acknowledge the original authors of the
structural data.