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Information card for entry 7025159
Preview
Coordinates | 7025159.cif |
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Original paper (by DOI) | HTML |
Formula | C28 H24 Fe N6 O2 |
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Calculated formula | C28 H24 Fe N6 O2 |
SMILES | [Fe]1234([n]5ccccc5C(C)=[N]1N=C(c1ccccc1)O3)[n]1ccccc1C(C)=[N]2N=C(c1ccccc1)O4 |
Title of publication | Synthesis, magnetic and photomagnetic study of new iron(ii) spin-crossover complexes with N4O2 coordination sphere |
Authors of publication | Zhang, Li; Xu, Guan-Cheng; Xu, Hong-Bin; Mereacre, Valeriu; Wang, Zhe-Ming; Powell, Annie K.; Gao, Song |
Journal of publication | Dalton Transactions |
Year of publication | 2010 |
Journal volume | 39 |
Journal issue | 20 |
Pages of publication | 4856 |
a | 9.982 ± 0.002 Å |
b | 20.133 ± 0.004 Å |
c | 12.113 ± 0.002 Å |
α | 90° |
β | 91.63 ± 0.03° |
γ | 90° |
Cell volume | 2433.3 ± 0.8 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 5 |
Space group number | 9 |
Hermann-Mauguin space group symbol | C 1 c 1 |
Hall space group symbol | C -2yc |
Residual factor for all reflections | 0.1389 |
Residual factor for significantly intense reflections | 0.1066 |
Weighted residual factors for significantly intense reflections | 0.2487 |
Weighted residual factors for all reflections included in the refinement | 0.2654 |
Goodness-of-fit parameter for all reflections included in the refinement | 1 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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