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Information card for entry 7135136
Preview
| Coordinates | 7135136.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C20 H18 O3 |
|---|---|
| Calculated formula | C20 H18 O3 |
| Title of publication | Photocyclisations of o-Iodobenzyl-Indanones and Tetralones infer the Intermediacy of Triplet Aryl Cations. |
| Authors of publication | Harrowven, David; Powderly, Marian; Lindup, Toby; Jackman, Edward Henry; Light, Mark E.; Legros, Julien; Chataigner, Isabelle |
| Journal of publication | Chemical Communications |
| Year of publication | 2025 |
| a | 7.8446 ± 0.0001 Å |
| b | 8.6853 ± 0.0001 Å |
| c | 11.0599 ± 0.0003 Å |
| α | 77.008 ± 0.002° |
| β | 83.439 ± 0.002° |
| γ | 81.312 ± 0.001° |
| Cell volume | 723.3 ± 0.02 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 3 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0319 |
| Residual factor for significantly intense reflections | 0.0312 |
| Weighted residual factors for significantly intense reflections | 0.0809 |
| Weighted residual factors for all reflections included in the refinement | 0.0815 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 303156 (current) | 2025-11-05 | cif/ Adding structures of 7135132, 7135133, 7135134, 7135135, 7135136, 7135137, 7135138 via cif-deposit CGI script. |
7135136.cif |
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Users of the data should acknowledge the original authors of the
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