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Information card for entry 7247702
Preview
| Coordinates | 7247702.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C21 H27 N3 O12 Tb |
|---|---|
| Calculated formula | C21 H27 N3 O12 Tb |
| Title of publication | A dual-emission Tb-based MOF induced by ESPT for ratiometric ammonia sensing |
| Authors of publication | Zhao, Yuming; Zhang, Rudie; Xiao, Cheng; Yue, Dan; Qin, Bowen; Liu, Jinhui; Wang, Zhenling; Fu, Yu |
| Journal of publication | CrystEngComm |
| Year of publication | 2023 |
| Journal volume | 25 |
| Journal issue | 47 |
| Pages of publication | 6528 - 6532 |
| a | 10.4819 ± 0.0007 Å |
| b | 10.9273 ± 0.0007 Å |
| c | 12.5634 ± 0.0007 Å |
| α | 104.646 ± 0.002° |
| β | 108.134 ± 0.002° |
| γ | 97.016 ± 0.002° |
| Cell volume | 1291.14 ± 0.14 Å3 |
| Cell temperature | 172.99 K |
| Ambient diffraction temperature | 172.99 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0207 |
| Residual factor for significantly intense reflections | 0.019 |
| Weighted residual factors for significantly intense reflections | 0.0466 |
| Weighted residual factors for all reflections included in the refinement | 0.0479 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.139 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 288790 (current) | 2024-01-06 | cif/ Updating files of 7247702 Original log message: Adding full bibliography for 7247702.cif. |
7247702.cif |
| 287528 | 2023-11-11 | cif/ Adding structures of 7247702 via cif-deposit CGI script. |
7247702.cif |
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Users of the data should acknowledge the original authors of the
structural data.