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Information card for entry 1566995
Preview
| Coordinates | 1566995.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | VL575 |
|---|---|
| Formula | C22 H27 N O5 |
| Calculated formula | C22 H27 N O5 |
| Title of publication | Energy transfer (EnT) photocatalysis enabled by Gold-N-heterocyclic carbene (NHC) complexes |
| Authors of publication | Martynova, Ekaterina A.; Voloshkin, Vladislav; Guillet, Sébastien; Bru, Francis; Belis, Marek; Van Hecke, Kristof; Cazin, Catherine; Nolan, Steven P. |
| Journal of publication | Chemical Science |
| Year of publication | 2022 |
| a | 7.4056 ± 0.0002 Å |
| b | 9.453 ± 0.0003 Å |
| c | 15.293 ± 0.0005 Å |
| α | 84.544 ± 0.002° |
| β | 81.654 ± 0.003° |
| γ | 83.321 ± 0.003° |
| Cell volume | 1048.73 ± 0.06 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0678 |
| Residual factor for significantly intense reflections | 0.0596 |
| Weighted residual factors for significantly intense reflections | 0.1717 |
| Weighted residual factors for all reflections included in the refinement | 0.181 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.062 |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 275526 (current) | 2022-05-19 | cif/ Adding structures of 1566995 via cif-deposit CGI script. |
1566995.cif |
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