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Information card for entry 7160468
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| Coordinates | 7160468.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C16 H14 O4 |
|---|---|
| Calculated formula | C16 H14 O4 |
| Title of publication | Dual Palladium-Organophotoredox Catalyzed C-H Olefination-Annulation of Aryl Carboxylic Acids |
| Authors of publication | Varma, Anagha A.; Gopinath, Purushothaman |
| Journal of publication | Organic & Biomolecular Chemistry |
| Year of publication | 2025 |
| a | 4.7983 ± 0.0002 Å |
| b | 12.3215 ± 0.0006 Å |
| c | 22.008 ± 0.0011 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1301.16 ± 0.11 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 3 |
| Space group number | 19 |
| Hermann-Mauguin space group symbol | P 21 21 21 |
| Hall space group symbol | P 2ac 2ab |
| Residual factor for all reflections | 0.0366 |
| Residual factor for significantly intense reflections | 0.0348 |
| Weighted residual factors for significantly intense reflections | 0.0923 |
| Weighted residual factors for all reflections included in the refinement | 0.0932 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 298684 (current) | 2025-04-02 | cif/ Adding structures of 7160467, 7160468 via cif-deposit CGI script. |
7160468.cif |
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