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Information card for entry 7250298
Preview
| Coordinates | 7250298.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C21 H19 Br N3 O3 Re |
|---|---|
| Calculated formula | C21 H19 Br N3 O3 Re |
| Title of publication | Light-driven CO2 reduction with substituted imidazole-pyridine Re catalysts favoring formic acid production |
| Authors of publication | Chafin, Ryan; Sujan, Majharul Islam; Parkin, Sean; Jurss, Jonah W.; Huckaba, Aron J. |
| Journal of publication | RSC Advances |
| Year of publication | 2025 |
| Journal volume | 15 |
| Journal issue | 16 |
| Pages of publication | 12547 - 12556 |
| a | 14.4135 ± 0.0006 Å |
| b | 13.9657 ± 0.0005 Å |
| c | 19.9434 ± 0.0009 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 4014.5 ± 0.3 Å3 |
| Cell temperature | 100 ± 0.2 K |
| Ambient diffraction temperature | 100 ± 0.2 K |
| Number of distinct elements | 6 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.0212 |
| Residual factor for significantly intense reflections | 0.0195 |
| Weighted residual factors for significantly intense reflections | 0.0434 |
| Weighted residual factors for all reflections included in the refinement | 0.044 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.163 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 299363 (current) | 2025-04-23 | cif/ Adding structures of 7250297, 7250298 via cif-deposit CGI script. |
7250298.cif |
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Users of the data should acknowledge the original authors of the
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