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Information card for entry 4516282
Preview
| Coordinates | 4516282.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C122 H172 O26 Sn4 |
|---|---|
| Calculated formula | C122 H142 O26 Sn4 |
| Title of publication | Molecular Dumbbell, Sandwich, and Paddle-Wheel Assembled with Methylresorcin[4]arene Cavitands and Organooxotin Clusters |
| Authors of publication | Dong, Yun-Bo; Shi, Hua-Yu; Yang, Jin; Liu, Ying-Ying; Ma, Jian-Fang |
| Journal of publication | Crystal Growth & Design |
| Year of publication | 2015 |
| Journal volume | 15 |
| Journal issue | 3 |
| Pages of publication | 1546 |
| a | 11.8 ± 0.0007 Å |
| b | 15.889 ± 0.0008 Å |
| c | 19.904 ± 0.0011 Å |
| α | 76.442 ± 0.005° |
| β | 73.057 ± 0.005° |
| γ | 76.388 ± 0.005° |
| Cell volume | 3413.9 ± 0.3 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.1983 |
| Residual factor for significantly intense reflections | 0.0987 |
| Weighted residual factors for significantly intense reflections | 0.2532 |
| Weighted residual factors for all reflections included in the refinement | 0.3223 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.166 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 231222 (current) | 2019-11-22 | cif/ Adding structures of 4516282, 4516283, 4516284, 4516285 via cif-deposit CGI script. |
4516282.cif |
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Users of the data should acknowledge the original authors of the
structural data.