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Information card for entry 7714461
Preview
| Coordinates | 7714461.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | HIAM-4034 |
|---|---|
| Formula | C86 H75 N9 O35 S3 Zr6 |
| Calculated formula | C86 H75 N9 O35 S3 Zr6 |
| Title of publication | Carboxyl Position Directed Structure Diversity in Zirconium-Tricarboxylate Frameworks |
| Authors of publication | Xia, Jun; Si, Jincheng; Zhou, Kang; Xia, Hai-Lun; Zhang, Jian; Xu, Yingqian; Wang, Lei; Liu, Xiao-Yuan |
| Journal of publication | Dalton Transactions |
| Year of publication | 2023 |
| a | 32.5504 ± 0.0006 Å |
| b | 32.5504 ± 0.0006 Å |
| c | 40.8188 ± 0.0013 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 37454.5 ± 1.5 Å3 |
| Cell temperature | 193.15 K |
| Ambient diffraction temperature | 193.15 K |
| Number of distinct elements | 6 |
| Space group number | 155 |
| Hermann-Mauguin space group symbol | R 3 2 :H |
| Hall space group symbol | R 3 2" |
| Residual factor for all reflections | 0.0736 |
| Residual factor for significantly intense reflections | 0.0481 |
| Weighted residual factors for significantly intense reflections | 0.1206 |
| Weighted residual factors for all reflections included in the refinement | 0.1336 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.982 |
| Diffraction radiation wavelength | 1.34139 Å |
| Diffraction radiation type | GaKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 287598 (current) | 2023-11-15 | cif/ Adding structures of 7714460, 7714461 via cif-deposit CGI script. |
7714461.cif |
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