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Information card for entry 1573828
Preview
Coordinates | 1573828.cif |
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Original paper (by DOI) | HTML |
Formula | C30 H30 Co N4 O2 |
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Calculated formula | C30 H30 Co N4 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 | 10.1242 ± 0.0003 Å |
b | 16.4696 ± 0.0004 Å |
c | 17.3838 ± 0.0004 Å |
α | 115.052 ± 0.001° |
β | 95.934 ± 0.002° |
γ | 98.372 ± 0.001° |
Cell volume | 2553.51 ± 0.12 Å3 |
Cell temperature | 133 ± 2 K |
Ambient diffraction temperature | 133 ± 2 K |
Number of distinct elements | 5 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0702 |
Residual factor for significantly intense reflections | 0.0552 |
Weighted residual factors for significantly intense reflections | 0.1065 |
Weighted residual factors for all reflections included in the refinement | 0.1161 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.133 |
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. |
1573828.cif |
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Users of the data should acknowledge the original authors of the
structural data.