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Information card for entry 7120343
Preview
| Coordinates | 7120343.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C132 H112 Cl2 N12 O22 P2 Ti6 |
|---|---|
| Calculated formula | C132 H112 Cl2 N12 O22 P2 Ti6 |
| Title of publication | Deep Eutectic-Solvothermal Synthesis of Titanium-Oxo Clusters Protected by π-Conjugate Chromophores |
| Authors of publication | Narayanam, Nagaraju; Fang, Wei-Hui; Chintakrinda, Kalpana; Zhang, Lei; Zhang, Jian |
| Journal of publication | Chem. Commun. |
| Year of publication | 2017 |
| a | 14.6424 ± 0.0008 Å |
| b | 15.0149 ± 0.0008 Å |
| c | 15.2824 ± 0.0007 Å |
| α | 79.639 ± 0.004° |
| β | 84.629 ± 0.004° |
| γ | 79.585 ± 0.004° |
| Cell volume | 3244.2 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1205 |
| Residual factor for significantly intense reflections | 0.1028 |
| Weighted residual factors for significantly intense reflections | 0.2938 |
| Weighted residual factors for all reflections included in the refinement | 0.321 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.32 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 198146 (current) | 2017-06-27 | cif/ Adding structures of 7120342, 7120343, 7120344, 7120345 via cif-deposit CGI script. |
7120343.cif |
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Users of the data should acknowledge the original authors of the
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