Crystallography Open Database
- COD Home
- Accessing COD Data
- Add Your Data
- Documentation
Information card for entry 7226183
Preview
| Coordinates | 7226183.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C36 H74 Cl4 N24 O30 Zn |
|---|---|
| Calculated formula | C36 H34.6667 Cl4 N24 O12 Zn |
| Title of publication | Supramolecular Assemblies Constructed from Inverted Cucurbit[7]uril and Lanthanide Cations: Synthesis, structure and sorption properties |
| Authors of publication | Li, Qing; Qiu, Sheng-Chao; Zhang, Yun-Qian; Xue, Sai-Feng; Tao, Zhu; Prior, Timothy J.; Redshaw, Carl; Xiao, Xin; Zhu, Qian-Jiang |
| Journal of publication | RSC Adv. |
| Year of publication | 2016 |
| a | 42.1444 ± 0.0017 Å |
| b | 19.0351 ± 0.0007 Å |
| c | 24.3731 ± 0.0008 Å |
| α | 90° |
| β | 93.459 ± 0.002° |
| γ | 90° |
| Cell volume | 19517 ± 1.2 Å3 |
| Cell temperature | 223 ± 2 K |
| Ambient diffraction temperature | 223 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0959 |
| Residual factor for significantly intense reflections | 0.0634 |
| Weighted residual factors for significantly intense reflections | 0.1852 |
| Weighted residual factors for all reflections included in the refinement | 0.2002 |
| 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 | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 185683 (current) | 2016-08-08 | cif/ Adding structures of 7226183, 7226184 via cif-deposit CGI script. |
7226183.cif |
All data in the COD and the database itself are dedicated to the
public domain and licensed under the
CC0
License
.
Users of the data should acknowledge the original authors of the
structural data.