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Information card for entry 4038342
Preview
| Coordinates | 4038342.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C34 H31 N3 O2 |
|---|---|
| Calculated formula | C34 H31 N3 O2 |
| Title of publication | Construction of Highly Functionalized Piperazinones <i>via</i> post-Ugi Cyclization and Diastereoselective Nucleophilic Addition. |
| Authors of publication | Tripathi, Shashank; Ambule, Mayur Diliprao; Srivastava, Ajay Kumar |
| Journal of publication | The Journal of organic chemistry |
| Year of publication | 2020 |
| a | 9.4834 ± 0.0008 Å |
| b | 10.9838 ± 0.0009 Å |
| c | 26.644 ± 0.002 Å |
| α | 90° |
| β | 98.619 ± 0.003° |
| γ | 90° |
| Cell volume | 2744 ± 0.4 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| 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 | 0.1018 |
| Residual factor for significantly intense reflections | 0.0519 |
| Weighted residual factors for significantly intense reflections | 0.1461 |
| Weighted residual factors for all reflections included in the refinement | 0.1791 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.089 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 251987 (current) | 2020-05-13 | cif/ Adding structures of 4038342 via cif-deposit CGI script. |
4038342.cif |
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