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Information card for entry 7245597
Preview
| Coordinates | 7245597.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C28 H16 Cl4 Cu2 N8 O28 |
|---|---|
| Calculated formula | C28 H16 Cl4 Cu2 N8 O28 |
| Title of publication | NIR light-driving deflagration of energetic copper complexes through photothermal effect |
| Authors of publication | Tan, Bin; Chen, Chao; Chen, Yun-Rui; Zhang, Jie; Yang, Guo-Yu |
| Journal of publication | CrystEngComm |
| Year of publication | 2022 |
| a | 8.1283 ± 0.0007 Å |
| b | 23.4063 ± 0.0019 Å |
| c | 11.9716 ± 0.001 Å |
| α | 90° |
| β | 108.067 ± 0.009° |
| γ | 90° |
| Cell volume | 2165.3 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.076 |
| Residual factor for significantly intense reflections | 0.0565 |
| Weighted residual factors for significantly intense reflections | 0.1459 |
| Weighted residual factors for all reflections included in the refinement | 0.161 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.043 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 278284 (current) | 2022-10-01 | cif/ Adding structures of 7245597, 7245598, 7245599 via cif-deposit CGI script. |
7245597.cif |
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Users of the data should acknowledge the original authors of the
structural data.