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Information card for entry 7157279
Preview
| Coordinates | 7157279.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C26 H29 N3 O6 S |
|---|---|
| Calculated formula | C26 H29 N3 O6 S |
| Title of publication | A highly efficient method for the construction of cyclopropane-containing dihydroindole derivatives from indolemethylenecyclopropanes with DIAD and DEAD. |
| Authors of publication | Chen, Mintao; Zang, Wenqing; Wei, Yin; Shi, Min |
| Journal of publication | Organic & biomolecular chemistry |
| Year of publication | 2020 |
| Journal volume | 18 |
| Journal issue | 2 |
| Pages of publication | 333 - 336 |
| a | 10.0889 ± 0.0002 Å |
| b | 23.6964 ± 0.0006 Å |
| c | 11.1762 ± 0.0003 Å |
| α | 90° |
| β | 91.175 ± 0.001° |
| γ | 90° |
| Cell volume | 2671.34 ± 0.11 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 5 |
| 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 | 0.0788 |
| Residual factor for significantly intense reflections | 0.0588 |
| Weighted residual factors for significantly intense reflections | 0.1505 |
| Weighted residual factors for all reflections included in the refinement | 0.1683 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.038 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301861 (current) | 2025-08-22 | Add cross-references to PubChem compounds in COD range 7/15/ Each referenced PubChem compound corresponds to the full crystal structure. |
7157279.cif |
| 247819 | 2020-02-04 | cif/ Updating files of 7157278, 7157279 Original log message: Adding full bibliography for 7157278--7157279.cif. |
7157279.cif |
| 246395 | 2020-01-01 | cif/ Adding structures of 7157278, 7157279 via cif-deposit CGI script. |
7157279.cif |
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Users of the data should acknowledge the original authors of the
structural data.