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Information card for entry 7123834
Preview
| Coordinates | 7123834.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C120 H188 Cl12 K6 Np3 O42 |
|---|---|
| Calculated formula | C120 H188 Cl12 K6 Np3 O42 |
| Title of publication | Exploring Crown-Ether Functionalization on the Stabilization of Hexavalent Neptunium. |
| Authors of publication | Pyrch, Mikaela; Williams, James; Forbes, Tori |
| Journal of publication | Chemical Communications |
| Year of publication | 2019 |
| a | 14.4462 ± 0.0013 Å |
| b | 20.1311 ± 0.0017 Å |
| c | 25.473 ± 0.002 Å |
| α | 90° |
| β | 91.278 ± 0.003° |
| γ | 90° |
| Cell volume | 7406.2 ± 1.1 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 6 |
| 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 | 0.0741 |
| Residual factor for significantly intense reflections | 0.0512 |
| Weighted residual factors for significantly intense reflections | 0.1086 |
| Weighted residual factors for all reflections included in the refinement | 0.1179 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.13 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 216982 (current) | 2019-07-13 | cif/ Adding structures of 7123834, 7123835 via cif-deposit CGI script. |
7123834.cif |
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Users of the data should acknowledge the original authors of the
structural data.