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Information card for entry 7039927
Preview
Coordinates | 7039927.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C34 H36 B2 F8 Fe N14 O3 |
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Calculated formula | C34 H36 B2 F8 Fe N14 O3 |
SMILES | [Fe]1234([n]5c([C@H]6Nc7c(C(=O)N6[N]1=Cc1c[nH]c[n]21)cccc7)c[nH]c5)[n]1c[nH]cc1C=[N]3N1[C@@H](c2c[nH]c[n]42)Nc2ccccc2C1=O.[B](F)(F)(F)[F-].[B](F)(F)(F)[F-].O(CC)CC |
Title of publication | Room-temperature switching of magnetic hysteresis by reversible single-crystal-to-single-crystal solvent exchange in imidazole-inspired Fe(ii) complexes. |
Authors of publication | Huang, Wei; Shen, Fuxing; Zhang, Ming; Wu, Dayu; Pan, Feifei; Sato, Osamu |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2016 |
Journal volume | 45 |
Journal issue | 38 |
Pages of publication | 14911 - 14918 |
a | 9.2819 ± 0.0007 Å |
b | 19.2352 ± 0.0014 Å |
c | 21.4352 ± 0.0015 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 3827 ± 0.5 Å3 |
Cell temperature | 123 ± 2 K |
Ambient diffraction temperature | 123 ± 2 K |
Number of distinct elements | 7 |
Space group number | 19 |
Hermann-Mauguin space group symbol | P 21 21 21 |
Hall space group symbol | P 2ac 2ab |
Residual factor for all reflections | 0.09 |
Residual factor for significantly intense reflections | 0.0666 |
Weighted residual factors for significantly intense reflections | 0.1676 |
Weighted residual factors for all reflections included in the refinement | 0.1852 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.157 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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