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Information card for entry 1503405
Preview
Coordinates | 1503405.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C18 H19 Br N2 O2 |
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Calculated formula | C18 H19 Br N2 O2 |
SMILES | c1(ccc(cc1)N1C(=O)[C@H]2[C@@H](C1=O)CN1[C@@H]2[C@@H](CCC1)C=C)Br.c1(ccc(cc1)N1C(=O)[C@@H]2[C@H](C1=O)CN1[C@H]2[C@H](CCC1)C=C)Br |
Title of publication | Highly diastereoselective synthesis of substituted pyrrolidines using a sequence of azomethine ylide cycloaddition and nucleophilic cyclization. |
Authors of publication | Bélanger, Guillaume; Darsigny, Véronique; Doré, Michaël; Lévesque, François |
Journal of publication | Organic letters |
Year of publication | 2010 |
Journal volume | 12 |
Journal issue | 7 |
Pages of publication | 1396 - 1399 |
a | 13.395 ± 0.004 Å |
b | 7.347 ± 0.003 Å |
c | 17.061 ± 0.012 Å |
α | 90° |
β | 92.33 ± 0.04° |
γ | 90° |
Cell volume | 1677.6 ± 1.5 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0943 |
Residual factor for significantly intense reflections | 0.0643 |
Weighted residual factors for significantly intense reflections | 0.1793 |
Weighted residual factors for all reflections included in the refinement | 0.1995 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.107 |
Diffraction radiation wavelength | 1.54176 Å |
Diffraction radiation type | CuKα |
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/1503405.html
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