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Information card for entry 7245937
Preview
| Coordinates | 7245937.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C8 H18 F2 N4 O5 S2 |
|---|---|
| Calculated formula | C8 H18 F2 N4 O5 S2 |
| Title of publication | Elucidating phase transformation of Eu-based metal organic framework with intermediate isolation and theoretical calculations |
| Authors of publication | Liu, Zhiqing; Wu, Ying; Zhong, Yuan-Hui; Chung, Lai-Hon; Liao, Wei-Ming; Yang, Xianghua; He, Jun |
| Journal of publication | CrystEngComm |
| Year of publication | 2023 |
| Journal volume | 25 |
| Journal issue | 3 |
| Pages of publication | 347 - 351 |
| a | 16.6143 ± 0.0005 Å |
| b | 10.5019 ± 0.0003 Å |
| c | 8.8282 ± 0.0003 Å |
| α | 90° |
| β | 103.725 ± 0.004° |
| γ | 90° |
| Cell volume | 1496.38 ± 0.08 Å3 |
| Cell temperature | 240.01 ± 0.1 K |
| Ambient diffraction temperature | 240.01 ± 0.1 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 | 0.0354 |
| Residual factor for significantly intense reflections | 0.0306 |
| Weighted residual factors for significantly intense reflections | 0.0802 |
| Weighted residual factors for all reflections included in the refinement | 0.0841 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.068 |
| 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 |
|---|---|---|---|
| 281458 (current) | 2023-03-04 | cif/ Updating files of 7245936, 7245937 Original log message: Adding full bibliography for 7245936--7245937.cif. |
7245937.cif |
| 279655 | 2022-12-01 | cif/ Adding structures of 7245936, 7245937 via cif-deposit CGI script. |
7245937.cif |
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Users of the data should acknowledge the original authors of the
structural data.