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Information card for entry 7225023
Preview
| Coordinates | 7225023.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C37 H30 Cl N3 O4 |
|---|---|
| Calculated formula | C37 H30 Cl N3 O4 |
| Title of publication | Indium chloride catalyzed three-component reaction for synthesis of 2-((oxoindolin-3-yl)-4,5,6,7-tetrahydro-1H-indol-1-yl)benzamides |
| Authors of publication | Jiang, Yan-Hong; Yan, Chao Guo |
| Journal of publication | RSC Adv. |
| Year of publication | 2016 |
| a | 11.044 ± 0.003 Å |
| b | 11.653 ± 0.003 Å |
| c | 13.855 ± 0.004 Å |
| α | 65.562 ± 0.006° |
| β | 75.046 ± 0.007° |
| γ | 87.93 ± 0.007° |
| Cell volume | 1563.3 ± 0.7 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.2478 |
| Residual factor for significantly intense reflections | 0.1046 |
| Weighted residual factors for significantly intense reflections | 0.261 |
| Weighted residual factors for all reflections included in the refinement | 0.3222 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.951 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301865 (current) | 2025-08-22 | Add cross-references to PubChem compounds in COD range 7/22/ Each referenced PubChem compound corresponds to the full crystal structure. |
7225023.cif |
| 182378 | 2016-04-28 | cif/ Adding structures of 7225023, 7225024, 7225025, 7225026 via cif-deposit CGI script. |
7225023.cif |
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Users of the data should acknowledge the original authors of the
structural data.