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Information card for entry 7712651
Preview
| Coordinates | 7712651.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C64 H34 N8 O8 Zn3 |
|---|---|
| Calculated formula | C64 H34 N8 O8 Zn3 |
| Title of publication | Porphyrin Metal-Organic Frameworks with Bilayer and Pillar-layered Frameworks for Third-order Nonlinear Optical Properties |
| Authors of publication | Zhu, Zi-Yi; Wang, Zirui; Li, Qiao-Hong; Ma, Zhi-Zhou; Wang, Fei; Zhang, Jian |
| Journal of publication | Dalton Transactions |
| Year of publication | 2023 |
| a | 23.5128 ± 0.0004 Å |
| b | 23.5272 ± 0.0003 Å |
| c | 18.2894 ± 0.0003 Å |
| α | 90° |
| β | 96.728 ± 0.002° |
| γ | 90° |
| Cell volume | 10047.8 ± 0.3 Å3 |
| Cell temperature | 99.99 ± 0.13 K |
| Ambient diffraction temperature | 99.99 ± 0.13 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 | 0.0872 |
| Residual factor for significantly intense reflections | 0.0815 |
| Weighted residual factors for significantly intense reflections | 0.2274 |
| Weighted residual factors for all reflections included in the refinement | 0.2327 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.055 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.3405 Å |
| Diffraction radiation type | GaKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 281938 (current) | 2023-03-18 | cif/ Adding structures of 7712650, 7712651 via cif-deposit CGI script. |
7712651.cif |
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