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Information card for entry 1546156
Preview
| Coordinates | 1546156.cif |
|---|---|
| Original paper (by DOI) | HTML |
| External links | PubChem |
| Formula | C23 H28 F3 Mn N2 O8 S |
|---|---|
| Calculated formula | C23 H28 F3 Mn N2 O8 S |
| Title of publication | Ferromagnetic Exchange Coupling in a Family of MnIII Salen-Type Schiff-Base Out-of-Plane Dimers |
| Authors of publication | Kachi-Terajima, Chihiro; Ishii, Rikako; Tojo, Yoshiaki; Fukuda, Masato; Kitagawa, Yasutaka; Asaoka, Mizuki; Miyasaka, Hitoshi |
| Journal of publication | The Journal of Physical Chemistry C |
| Year of publication | 2017 |
| a | 7.416 ± 0.007 Å |
| b | 17.927 ± 0.016 Å |
| c | 18.623 ± 0.017 Å |
| α | 90° |
| β | 93.457 ± 0.011° |
| γ | 90° |
| Cell volume | 2471 ± 4 Å3 |
| Cell temperature | 103 K |
| Ambient diffraction temperature | 103 K |
| Number of distinct elements | 7 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/c 1 |
| Hall space group symbol | -P 2ybc |
| Residual factor for significantly intense reflections | 0.0744 |
| Weighted residual factors for all reflections included in the refinement | 0.1725 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.125 |
| Diffraction radiation wavelength | 0.7107 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 301779 (current) | 2025-08-18 | Add cross-references to PubChem compounds in COD range 1/54 Each referenced PubChem compound corresponds to the full crystal structure. |
1546156.cif |
| 197100 | 2017-06-01 | cif/ Adding structures of 1546156 via cif-deposit CGI script. |
1546156.cif |
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