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Information card for entry 1573942
Preview
| Coordinates | 1573942.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C56 H61 Cu F3 N8 O9 S |
|---|---|
| Calculated formula | C56 H61 Cu F3 N8 O9 S |
| Title of publication | Unusually air-stable copper(i) complexes showing high selectivity for carbon monoxide. |
| Authors of publication | Saeednia, Borna; Sragow, Aria M.; Lin, Yannan; Sheehan, Colton J.; Metlay, Amy S.; Gau, Michael R.; Dye, Samantha A.; O'Konski, Sarah P; Mallouk, Thomas E.; Dmochowski, Ivan J. |
| Journal of publication | Chemical science |
| Year of publication | 2025 |
| Journal volume | 16 |
| Journal issue | 12 |
| Pages of publication | 5058 - 5063 |
| a | 18.0509 ± 0.0004 Å |
| b | 16.2265 ± 0.0002 Å |
| c | 20.4026 ± 0.0005 Å |
| α | 90° |
| β | 115.111 ± 0.003° |
| γ | 90° |
| Cell volume | 5411.2 ± 0.2 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 100 K |
| Number of distinct elements | 7 |
| 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 | 0.0474 |
| Residual factor for significantly intense reflections | 0.0403 |
| Weighted residual factors for significantly intense reflections | 0.0969 |
| Weighted residual factors for all reflections included in the refinement | 0.0998 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.047 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 298817 (current) | 2025-04-05 | cif/ Updating files of 1573940, 1573941, 1573942 Original log message: Adding full bibliography for 1573940--1573942.cif. |
1573942.cif |
| 297772 | 2025-02-20 | cif/ Adding structures of 1573940, 1573941, 1573942 via cif-deposit CGI script. |
1573942.cif |
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Users of the data should acknowledge the original authors of the
structural data.