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Information card for entry 7244721
Preview
| Coordinates | 7244721.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C64 H100 N4 O28 Ti8 |
|---|---|
| Calculated formula | C64 H100 N4 O28 Ti8 |
| Title of publication | A family of oxime-based titanium-oxo clusters: synthesis, structures, and photoelectric responses |
| Authors of publication | Wang, Chao; Chen, Ning; Kong, Fangong; Wang, Shoujuan |
| Journal of publication | CrystEngComm |
| Year of publication | 2022 |
| a | 13.5956 ± 0.0005 Å |
| b | 14.9312 ± 0.0005 Å |
| c | 20.3151 ± 0.0007 Å |
| α | 93.9774 ± 0.0015° |
| β | 95.1157 ± 0.0014° |
| γ | 100.33 ± 0.0015° |
| Cell volume | 4025.6 ± 0.2 Å3 |
| Cell temperature | 150 K |
| Ambient diffraction temperature | 150 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 | 0.0684 |
| Residual factor for significantly intense reflections | 0.0477 |
| Weighted residual factors for significantly intense reflections | 0.1256 |
| Weighted residual factors for all reflections included in the refinement | 0.1416 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.019 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 274405 (current) | 2022-04-07 | cif/ Adding structures of 7244720, 7244721, 7244722, 7244723, 7244724 via cif-deposit CGI script. |
7244721.cif |
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Users of the data should acknowledge the original authors of the
structural data.