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Information card for entry 7709997
Preview
| Coordinates | 7709997.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C45 H39 Co N4 O6 S2 |
|---|---|
| Calculated formula | C45 H39 Co N4 O5.5 S2 |
| Title of publication | Phonon-induced relaxation mechanisms are changed by a chelating effect in a CoII single-ion magnet |
| Authors of publication | Lou, Yu-Siang; Lin, Bo-Ruei; Wu, Chen-Ming; Chien, Su-Ying; Yang, En-Che |
| Journal of publication | Dalton Transactions |
| Year of publication | 2022 |
| a | 19.5098 ± 0.0016 Å |
| b | 31.08 ± 0.003 Å |
| c | 14.1457 ± 0.0012 Å |
| α | 90° |
| β | 104.583 ± 0.003° |
| γ | 90° |
| Cell volume | 8301.1 ± 1.3 Å3 |
| Cell temperature | 150 ± 2 K |
| Ambient diffraction temperature | 150 ± 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 | 0.1092 |
| Residual factor for significantly intense reflections | 0.0859 |
| Weighted residual factors for significantly intense reflections | 0.2097 |
| Weighted residual factors for all reflections included in the refinement | 0.2214 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.355 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 274462 (current) | 2022-04-12 | cif/ Adding structures of 7709995, 7709996, 7709997 via cif-deposit CGI script. |
7709997.cif |
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Users of the data should acknowledge the original authors of the
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