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Information card for entry 2223621
Preview
Coordinates | 2223621.cif |
---|---|
Structure factors | 2223621.hkl |
Original IUCr paper | HTML |
Chemical name | <i>c</i>-3,<i>t</i>-3-Dimethyl-4-oxo-<i>r</i>-2,<i>c</i>-6-diphenylpiperidine-1-carboxamide |
---|---|
Formula | C26 H26 N2 O2 |
Calculated formula | C26 H26 N2 O2 |
SMILES | [C@@H]1(C(C(=O)C[C@@H](c2ccccc2)N1C(=O)Nc1ccccc1)(C)C)c1ccccc1.[C@H]1(C(C(=O)C[C@H](c2ccccc2)N1C(=O)Nc1ccccc1)(C)C)c1ccccc1 |
Title of publication | <i>c</i>-3,<i>t</i>-3-Dimethyl-4-oxo-<i>r</i>-2,<i>c</i>-6-diphenylpiperidine-1-carboxamide |
Authors of publication | Thenmozhi, M.; Kavitha, T.; Ponnuswamy, S.; Jamesh, M.; Ponnuswamy, M. N. |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2009 |
Journal volume | 65 |
Journal issue | 11 |
Pages of publication | o2808 |
a | 9.6648 ± 0.0002 Å |
b | 10.7938 ± 0.0003 Å |
c | 11.4233 ± 0.0003 Å |
α | 101.303 ± 0.002° |
β | 90.158 ± 0.001° |
γ | 113.191 ± 0.001° |
Cell volume | 1069.91 ± 0.05 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 4 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0664 |
Residual factor for significantly intense reflections | 0.0448 |
Weighted residual factors for significantly intense reflections | 0.1144 |
Weighted residual factors for all reflections included in the refinement | 0.1291 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.029 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2223621.html
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Users of the data should acknowledge the original authors of the
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