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Information card for entry 7249652
Preview
| Coordinates | 7249652.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C10 H18 Cu I3 N4 |
|---|---|
| Calculated formula | C10 H18 Cu I3 N4 |
| Title of publication | Optical properties of [MMim]2[CuI3] crystals with 0D single-core trigonal planar structures |
| Authors of publication | Han, Jiali; Zhu, Shujun; Chen, Xinxin; Zhou, Haichao; Pan, Jianguo; Pan, Shangke |
| Journal of publication | CrystEngComm |
| Year of publication | 2024 |
| a | 8.1644 ± 0.001 Å |
| b | 14.9055 ± 0.0016 Å |
| c | 15.8041 ± 0.0018 Å |
| α | 90° |
| β | 103.034 ± 0.004° |
| γ | 90° |
| Cell volume | 1873.7 ± 0.4 Å3 |
| Cell temperature | 193 K |
| Ambient diffraction temperature | 193 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0406 |
| Residual factor for significantly intense reflections | 0.0322 |
| Weighted residual factors for significantly intense reflections | 0.0705 |
| Weighted residual factors for all reflections included in the refinement | 0.0757 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.028 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 296171 (current) | 2024-11-30 | cif/ Adding structures of 7249652 via cif-deposit CGI script. |
7249652.cif |
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Users of the data should acknowledge the original authors of the
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