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Information card for entry 7713687
Preview
| Coordinates | 7713687.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C56 H48 Cu4 N4 S8 |
|---|---|
| Calculated formula | C56 H48 Cu4 N4 S8 |
| Title of publication | Tetracopper(I) thiolate- and amido-(SNS) complexes and copper-catalyzed azide-alkyne cycloaddition in water |
| Authors of publication | Khanzadeh, Atousa; Ataie, Saeed; Baker, R. Tom |
| Journal of publication | Dalton Transactions |
| Year of publication | 2023 |
| a | 24.1902 ± 0.0011 Å |
| b | 24.1902 ± 0.0011 Å |
| c | 22.8468 ± 0.0012 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 13369.2 ± 1.1 Å3 |
| Cell temperature | 203 ± 2 K |
| Ambient diffraction temperature | 203 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 142 |
| Hermann-Mauguin space group symbol | I 41/a c d :2 |
| Hall space group symbol | -I 4bd 2c |
| Residual factor for all reflections | 0.1684 |
| Residual factor for significantly intense reflections | 0.1409 |
| Weighted residual factors for significantly intense reflections | 0.321 |
| Weighted residual factors for all reflections included in the refinement | 0.3352 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.134 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 285592 (current) | 2023-08-09 | cif/ Adding structures of 7713687, 7713688 via cif-deposit CGI script. |
7713687.cif |
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