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Information card for entry 7718373
Preview
| Coordinates | 7718373.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C13 H12 Cu2 I2 N4 S |
|---|---|
| Calculated formula | C13 H12 Cu2 I2 N4 S |
| Title of publication | Visible-light harvesting 2D copper-cluster-based MOFs as efficient ROS generators for selective oxidation of amines |
| Authors of publication | Huang, Huilin; Yang, Qiong; Yao, Kun; Geng, Wen-Chao; Jing, Xu |
| Journal of publication | Dalton Transactions |
| Year of publication | 2025 |
| a | 9.2042 ± 0.0007 Å |
| b | 9.2118 ± 0.0007 Å |
| c | 12.363 ± 0.0009 Å |
| α | 99.783 ± 0.002° |
| β | 99.239 ± 0.001° |
| γ | 119.037 ± 0.002° |
| Cell volume | 866.47 ± 0.11 Å3 |
| Cell temperature | 200 ± 2 K |
| Ambient diffraction temperature | 200 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.042 |
| Residual factor for significantly intense reflections | 0.0307 |
| Weighted residual factors for significantly intense reflections | 0.0612 |
| Weighted residual factors for all reflections included in the refinement | 0.0648 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.021 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 298529 (current) | 2025-03-20 | cif/ Adding structures of 7718373 via cif-deposit CGI script. |
7718373.cif |
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