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Information card for entry 1574602
Preview
| Coordinates | 1574602.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | D-6 |
|---|---|
| Formula | C2.6 H0.05 N0.4 O1.2 Zn0.2 |
| Calculated formula | C2.6 H2.4 N0.4 O1.2 Zn0.2 |
| Title of publication | Rational Design of Circularly Polarized Luminescence Active Chiral Metal-organic Frameworks for Logic Device |
| Authors of publication | Zheng, Hongrui; Wang, Qingqing; Wang, Fei; Li, Shangda; Zhang, Jian |
| Journal of publication | Chemical Science |
| Year of publication | 2025 |
| a | 8.5952 ± 0.0002 Å |
| b | 11.3099 ± 0.0002 Å |
| c | 14.1931 ± 0.0003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 1379.72 ± 0.05 Å3 |
| Cell temperature | 99.98 ± 0.18 K |
| Ambient diffraction temperature | 99.98 ± 0.18 K |
| Number of distinct elements | 5 |
| Space group number | 18 |
| Hermann-Mauguin space group symbol | P 21 21 2 |
| Hall space group symbol | P 2 2ab |
| Residual factor for all reflections | 0.0404 |
| Residual factor for significantly intense reflections | 0.0337 |
| Weighted residual factors for significantly intense reflections | 0.0781 |
| Weighted residual factors for all reflections included in the refinement | 0.0817 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.045 |
| 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 |
|---|---|---|---|
| 299620 (current) | 2025-05-13 | cif/ Adding structures of 1574599, 1574600, 1574601, 1574602, 1574603, 1574604 via cif-deposit CGI script. |
1574602.cif |
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Users of the data should acknowledge the original authors of the
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