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Information card for entry 4348940
Preview
| Coordinates | 4348940.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | C43H55FN9O11S2 |
|---|---|
| Formula | C43 H55 Fe N9 O11 S2 |
| Calculated formula | C43 H55 Fe N9 O11 S2 |
| Title of publication | Structural and magnetic tuning from a field-induced single-ion magnet to a single-chain magnet by anions |
| Authors of publication | Shao, Dong; Zhao, Xin-Hua; Zhang, Shao-Liang; Wu, Dong-Qing; Wei, Xiao-Qin; Wang, Xin-Yi |
| Journal of publication | Inorganic Chemistry Frontiers |
| Year of publication | 2015 |
| Journal volume | 2 |
| Journal issue | 9 |
| Pages of publication | 846 |
| a | 8.5081 ± 0.0018 Å |
| b | 11.345 ± 0.002 Å |
| c | 24.713 ± 0.005 Å |
| α | 76.947 ± 0.003° |
| β | 87.749 ± 0.003° |
| γ | 85.552 ± 0.003° |
| Cell volume | 2316.2 ± 0.8 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 2 K |
| Number of distinct elements | 6 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0846 |
| Residual factor for significantly intense reflections | 0.0688 |
| Weighted residual factors for significantly intense reflections | 0.1836 |
| Weighted residual factors for all reflections included in the refinement | 0.1959 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.01 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 233499 (current) | 2019-11-23 | cif/ Adding structures of 4348940, 4348941 via cif-deposit CGI script. |
4348940.cif |
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Users of the data should acknowledge the original authors of the
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