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Information card for entry 7064005
Preview
| Coordinates | 7064005.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C47 H26 Ag2 Fe N7 O3 |
|---|---|
| Calculated formula | C47 H26 Ag2 Fe N7 O3 |
| Title of publication | A Three-Dimensional Hofmann-type Metal-Organic Framework with Switchable Spin Crossover and Fluorescent Properties |
| Authors of publication | Yan, Fei-Fei; Zhou, Ren-He; Li, Xin-Feng; Zhao, Liang; Meng, Yin-Shan |
| Journal of publication | New Journal of Chemistry |
| Year of publication | 2025 |
| a | 21.9114 ± 0.0011 Å |
| b | 10.235 ± 0.0005 Å |
| c | 20.2779 ± 0.001 Å |
| α | 90° |
| β | 95.608 ± 0.002° |
| γ | 90° |
| Cell volume | 4525.8 ± 0.4 Å3 |
| Cell temperature | 120 ± 2 K |
| Ambient diffraction temperature | 120 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 | 0.0886 |
| Residual factor for significantly intense reflections | 0.057 |
| Weighted residual factors for significantly intense reflections | 0.1325 |
| Weighted residual factors for all reflections included in the refinement | 0.149 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.022 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 302121 (current) | 2025-09-12 | cif/ Adding structures of 7064005, 7064006 via cif-deposit CGI script. |
7064005.cif |
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