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Information card for entry 7238775
Preview
| Coordinates | 7238775.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C70 H82 N6 O24 S6 |
|---|---|
| Calculated formula | C70 H82 N6 O24 S6 |
| Title of publication | The recognition of 1,5-naphthalenedisulfonate by a protonated azamacrocyclic ligand |
| Authors of publication | Xie, Gao-Yi; Jiang, Long; Lu, Tong-Bu |
| Journal of publication | RSC Advances |
| Year of publication | 2012 |
| Journal volume | 2 |
| Journal issue | 33 |
| Pages of publication | 12728 |
| a | 13.3839 ± 0.0007 Å |
| b | 22.0863 ± 0.0013 Å |
| c | 11.7496 ± 0.0005 Å |
| α | 90° |
| β | 95.793 ± 0.004° |
| γ | 90° |
| Cell volume | 3455.5 ± 0.3 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for all reflections | 0.0751 |
| Residual factor for significantly intense reflections | 0.0616 |
| Weighted residual factors for significantly intense reflections | 0.1648 |
| Weighted residual factors for all reflections included in the refinement | 0.181 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.031 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 244343 (current) | 2019-11-28 | cif/ Adding structures of 7238774, 7238775 via cif-deposit CGI script. |
7238775.cif |
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Users of the data should acknowledge the original authors of the
structural data.