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Information card for entry 4133005
Preview
| Coordinates | 4133005.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C187 H633 Br12 Gd60 N15 O399 |
|---|---|
| Calculated formula | C32 H36 Br12 Gd60 O224 |
| Title of publication | Exploring the Performance Improvement of Magnetocaloric Effect Based Gd-Exclusive Cluster Gd<sub>60</sub>. |
| Authors of publication | Luo, Xi-Ming; Hu, Zhao-Bo; Lin, Qing-Fang; Cheng, Weiwei; Cao, Jia-Peng; Cui, Chen-Hui; Mei, Hua; Song, You; Xu, Yan |
| Journal of publication | Journal of the American Chemical Society |
| Year of publication | 2018 |
| Journal volume | 140 |
| Journal issue | 36 |
| Pages of publication | 11219 - 11222 |
| a | 26.4448 ± 0.0019 Å |
| b | 26.4448 ± 0.0019 Å |
| c | 34.036 ± 0.003 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 23802 ± 3 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 87 |
| Hermann-Mauguin space group symbol | I 4/m |
| Hall space group symbol | -I 4 |
| Residual factor for all reflections | 0.1625 |
| Residual factor for significantly intense reflections | 0.098 |
| Weighted residual factors for significantly intense reflections | 0.2788 |
| Weighted residual factors for all reflections included in the refinement | 0.3201 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.108 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 242858 (current) | 2019-11-26 | cif/ Adding structures of 4133005 via cif-deposit CGI script. |
4133005.cif |
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Users of the data should acknowledge the original authors of the
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