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Information card for entry 1529410
Preview
| Coordinates | 1529410.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Chemical name | [(TPyA)2 Co2 (NMePh)L2-] 2BArF |
|---|---|
| Formula | C134 H76 B2 Co2 F48 N12 |
| Calculated formula | C134 H90 B2 Co2 F48 N12 |
| Title of publication | A series of tetraazalene radical-bridged M2(M = CrIII, MnII, FeII, CoII) complexes with strong magnetic exchange coupling |
| Authors of publication | DeGayner, Jordan A.; Jeon, Ie-Rang; Harris, T. David |
| Journal of publication | Chem. Sci. |
| Year of publication | 2015 |
| Journal volume | 6 |
| Journal issue | 11 |
| Pages of publication | 6639 |
| a | 14.8476 ± 0.0004 Å |
| b | 15.9017 ± 0.0004 Å |
| c | 18.21 ± 0.0005 Å |
| α | 75.56 ± 0.002° |
| β | 67.648 ± 0.002° |
| γ | 68.82 ± 0.002° |
| Cell volume | 3676.39 ± 0.18 Å3 |
| Cell temperature | 100 K |
| Ambient diffraction temperature | 99.99 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 | 0.0934 |
| Residual factor for significantly intense reflections | 0.0668 |
| Weighted residual factors for significantly intense reflections | 0.1773 |
| Weighted residual factors for all reflections included in the refinement | 0.1936 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.066 |
| Diffraction radiation wavelength | 1.54178 Å |
| Diffraction radiation type | CuKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 170990 (current) | 2015-12-09 | cif/ Updating files of 1529407, 1529408, 1529409, 1529410, 1529411 Original log message: Adding full bibliography for 1529407--1529411.cif. |
1529410.cif |
| 153499 | 2015-08-19 | cif/ Adding structures of 1529407, 1529408, 1529409, 1529410, 1529411 via cif-deposit CGI script. |
1529410.cif |
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Users of the data should acknowledge the original authors of the
structural data.