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Information card for entry 4130668
Preview
| Coordinates | 4130668.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C24 H60 Br6 Ce N3 |
|---|---|
| Calculated formula | C24 H60 Br6 Ce N3 |
| Title of publication | The Hexachlorocerate(III) Anion: A Potent, Benchtop Stable, and Readily Available Ultraviolet A Photosensitizer for Aryl Chlorides. |
| Authors of publication | Yin, Haolin; Jin, Yi; Hertzog, Jerald E.; Mullane, Kimberly C.; Carroll, Patrick J.; Manor, Brian C.; Anna, Jessica M.; Schelter, Eric J. |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2016 |
| Journal volume | 138 |
| Journal issue | 50 |
| Pages of publication | 16266 - 16273 |
| a | 11.7573 ± 0.0014 Å |
| b | 17.709 ± 0.002 Å |
| c | 12.2838 ± 0.0014 Å |
| α | 90° |
| β | 110.678 ± 0.005° |
| γ | 90° |
| Cell volume | 2392.8 ± 0.5 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 ± 1 K |
| Number of distinct elements | 5 |
| 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 | 0.0194 |
| Residual factor for significantly intense reflections | 0.0162 |
| Weighted residual factors for significantly intense reflections | 0.0369 |
| Weighted residual factors for all reflections included in the refinement | 0.0376 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.048 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 241058 (current) | 2019-11-25 | cif/ Adding structures of 4130666, 4130667, 4130668 via cif-deposit CGI script. |
4130668.cif |
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Users of the data should acknowledge the original authors of the
structural data.