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Information card for entry 7710978
Preview
| Coordinates | 7710978.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C34 H30 Br2 Cl8 Cu3 N2 O18 |
|---|---|
| Calculated formula | C34 H30 Br2 Cl8 Cu3 N2 O18 |
| Title of publication | Thermal Induced Charge Transfer in Quinoid-bridged Linear Cu3 Compound |
| Authors of publication | Liu, Xiao-Lin; Zhang, Xiao-Yi; Zhao, Hai-Xia; Long, La-Sheng; Zheng, Lansun |
| Journal of publication | Dalton Transactions |
| Year of publication | 2022 |
| a | 7.2675 ± 0.0002 Å |
| b | 12.4908 ± 0.0003 Å |
| c | 12.5292 ± 0.0003 Å |
| α | 98.477 ± 0.002° |
| β | 95.12 ± 0.002° |
| γ | 95.417 ± 0.002° |
| Cell volume | 1113.75 ± 0.05 Å3 |
| Cell temperature | 299.99 ± 0.1 K |
| Ambient diffraction temperature | 299.99 ± 0.1 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0643 |
| Residual factor for significantly intense reflections | 0.0608 |
| Weighted residual factors for significantly intense reflections | 0.1736 |
| Weighted residual factors for all reflections included in the refinement | 0.1795 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.073 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 277251 (current) | 2022-08-16 | cif/ Adding structures of 7710977, 7710978 via cif-deposit CGI script. |
7710978.cif |
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