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Information card for entry 7702341
Preview
| Coordinates | 7702341.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C18 H38 Gd N11 O13 |
|---|---|
| Calculated formula | C18 H34 Gd N11 O13 |
| Title of publication | A gadolinium cryptate with two coordinated water molecules |
| Authors of publication | Bligh, S. W. Annie; Drew, Michael G. B.; Martin, Noreen; Maubert, Beatrice; Nelson, Jane |
| Journal of publication | Journal of the Chemical Society, Dalton Transactions |
| Year of publication | 1998 |
| Journal issue | 22 |
| Pages of publication | 3711 |
| a | 15.798 ± 0.012 Å |
| b | 14.1 ± 0.012 Å |
| c | 13.736 ± 0.012 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 3060 ± 4 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 33 |
| Hermann-Mauguin space group symbol | P n 21 a |
| Hall space group symbol | P -2ac -2n |
| Residual factor for all reflections | 0.052 |
| Residual factor for significantly intense reflections | 0.0422 |
| Weighted residual factors for significantly intense reflections | 0.1299 |
| Weighted residual factors for all reflections included in the refinement | 0.1435 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.079 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 243832 (current) | 2019-11-28 | cif/ Adding structures of 7702341 via cif-deposit CGI script. |
7702341.cif |
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Users of the data should acknowledge the original authors of the
structural data.