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Information card for entry 1573830
Preview
| Coordinates | 1573830.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C28 H24 Co N2 O2 |
|---|---|
| Calculated formula | C28 H24 Co N2 O2 |
| Title of publication | THz-EPR-based Magneto-Structural Correlations for Cobalt(II) Single-Ion Magnets With Bis-Chelate Coordination |
| Authors of publication | Maximilian H. Pohle; Thomas Lohmiller; Michael Böhme; Michał Rams; Sven Ziegenbalg; Helmar Görls; Alexander Schnegg; Winfried Plass |
| Journal of publication | Chemistry - A European Journal |
| Year of publication | 2024 |
| Journal volume | 30 |
| Journal issue | 60 |
| Pages of publication | e202401545(1) - e202401545(14) |
| a | 22.0247 ± 0.0009 Å |
| b | 8.4669 ± 0.0003 Å |
| c | 11.8644 ± 0.0005 Å |
| α | 90° |
| β | 95.495 ± 0.003° |
| γ | 90° |
| Cell volume | 2202.32 ± 0.15 Å3 |
| Cell temperature | 133 ± 2 K |
| Ambient diffraction temperature | 133 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 15 |
| Hermann-Mauguin space group symbol | C 1 2/c 1 |
| Hall space group symbol | -C 2yc |
| Residual factor for all reflections | 0.0357 |
| Residual factor for significantly intense reflections | 0.0316 |
| Weighted residual factors for significantly intense reflections | 0.0721 |
| Weighted residual factors for all reflections included in the refinement | 0.0742 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.1 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 297563 (current) | 2025-02-01 | cif/ Adding structures of 1573828, 1573829, 1573830, 1573831 via cif-deposit CGI script. |
1573830.cif |
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Users of the data should acknowledge the original authors of the
structural data.