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Information card for entry 7134364
Preview
| Coordinates | 7134364.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C16 H24 N12 O8 S2 |
|---|---|
| Calculated formula | C16 H24 N12 O8 S2 |
| Title of publication | Anthraquinone substituents modulate the ionic hydrogen-bonded organic frameworks to achieve high ionic conductivity for alkali metal ions |
| Authors of publication | Chen, Xu-Yong; Fei, Gui-qiang; Bai, Xiang-Tian; Qi, Simeng; Cao, Xiao-Jie; Gao, Yi-Da; Luo, Xin; Cao, Li-Hui |
| Journal of publication | Chemical Communications |
| Year of publication | 2025 |
| a | 6.8832 ± 0.0001 Å |
| b | 14.6525 ± 0.0002 Å |
| c | 23.2897 ± 0.0004 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 2348.91 ± 0.06 Å3 |
| Cell temperature | 212.99 ± 0.1 K |
| Ambient diffraction temperature | 212.99 ± 0.1 K |
| Number of distinct elements | 5 |
| Space group number | 61 |
| Hermann-Mauguin space group symbol | P b c a |
| Hall space group symbol | -P 2ac 2ab |
| Residual factor for all reflections | 0.0421 |
| Residual factor for significantly intense reflections | 0.0392 |
| Weighted residual factors for significantly intense reflections | 0.1094 |
| Weighted residual factors for all reflections included in the refinement | 0.1127 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.06 |
| 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 |
|---|---|---|---|
| 298646 (current) | 2025-03-29 | cif/ Adding structures of 7134363, 7134364 via cif-deposit CGI script. |
7134364.cif |
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Users of the data should acknowledge the original authors of the
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