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Information card for entry 7221138
Preview
| Coordinates | 7221138.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C36 H58 Cl6 Hg3 N8 O2 |
|---|---|
| Calculated formula | C36 H58 Cl6 Hg3 N8 O2 |
| Title of publication | Synthesis and structures of dinuclear cryptates with Zn(ii), Cd(ii) and Hg(ii): tuning the cascade binding mode with metal ions |
| Authors of publication | Yan, Feng; Zhuang, Xiao-Mei; Lu, Tong-Bu |
| Journal of publication | CrystEngComm |
| Year of publication | 2015 |
| Journal volume | 17 |
| Journal issue | 30 |
| Pages of publication | 5832 |
| a | 10.0947 ± 0.0003 Å |
| b | 18.4694 ± 0.0005 Å |
| c | 26.2626 ± 0.0007 Å |
| α | 90° |
| β | 99.587 ± 0.003° |
| γ | 90° |
| Cell volume | 4828.1 ± 0.2 Å3 |
| Cell temperature | 150 ± 0.1 K |
| Ambient diffraction temperature | 150 ± 0.1 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 | 0.0603 |
| Residual factor for significantly intense reflections | 0.049 |
| Weighted residual factors for significantly intense reflections | 0.1264 |
| Weighted residual factors for all reflections included in the refinement | 0.1349 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.052 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 1.54184 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 176428 (current) | 2016-02-13 | Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively. |
7221138.cif |
| 153104 | 2015-08-08 | cif/ Updating files of 7221133, 7221134, 7221135, 7221136, 7221137, 7221138, 7221139, 7221140 Original log message: Adding full bibliography for 7221133--7221140.cif. |
7221138.cif |
| 141462 | 2015-07-09 | cif/ Adding structures of 7221133, 7221134, 7221135, 7221136, 7221137, 7221138, 7221139, 7221140 via cif-deposit CGI script. |
7221138.cif |
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Users of the data should acknowledge the original authors of the
structural data.