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Information card for entry 7709996
Preview
| Coordinates | 7709996.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C36.5 H44 Cl Co N6 O4.5 S2 |
|---|---|
| Calculated formula | C36.5 H44 Cl Co N6 O4.5 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 | 18.7232 ± 0.0014 Å |
| b | 12.826 ± 0.0009 Å |
| c | 32.042 ± 0.003 Å |
| α | 90° |
| β | 95.582 ± 0.007° |
| γ | 90° |
| Cell volume | 7658.2 ± 1.1 Å3 |
| Cell temperature | 100 ± 2 K |
| Ambient diffraction temperature | 100 ± 2 K |
| Number of distinct elements | 7 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Residual factor for all reflections | 0.1906 |
| Residual factor for significantly intense reflections | 0.0888 |
| Weighted residual factors for significantly intense reflections | 0.1993 |
| Weighted residual factors for all reflections included in the refinement | 0.2873 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.066 |
| 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. |
7709996.cif |
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Users of the data should acknowledge the original authors of the
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