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Information card for entry 7230559
Preview
| Coordinates | 7230559.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C105 H127 F9 O52 Ti13 |
|---|---|
| Calculated formula | C105 H117 F9 O52 Ti13 |
| Title of publication | Structures and photophysical performances of (fluoro)salicylate stabilized polyoxo-titanium clusters |
| Authors of publication | Zhu, Bang-Chang; Fang, Wei-Hui; Emayavaramban, Perumal; Zhang, Lei; Zhang, Jian |
| Journal of publication | CrystEngComm |
| Year of publication | 2018 |
| Journal volume | 20 |
| Journal issue | 39 |
| Pages of publication | 5964 |
| a | 15.582 ± 0.003 Å |
| b | 19.365 ± 0.002 Å |
| c | 22.631 ± 0.004 Å |
| α | 91.544 ± 0.007° |
| β | 92.106 ± 0.015° |
| γ | 93.021 ± 0.013° |
| Cell volume | 6811.9 ± 1.9 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 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 | 0.1636 |
| Residual factor for significantly intense reflections | 0.0925 |
| Weighted residual factors for significantly intense reflections | 0.2263 |
| Weighted residual factors for all reflections included in the refinement | 0.2754 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.036 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 228983 (current) | 2019-11-17 | cif/ Updating files of 7230559, 7230560 Original log message: Adding full bibliography for 7230559--7230560.cif. |
7230559.cif |
| 207469 | 2018-04-25 | cif/ Adding structures of 7230559, 7230560 via cif-deposit CGI script. |
7230559.cif |
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Users of the data should acknowledge the original authors of the
structural data.