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Information card for entry 7038955
Preview
Coordinates | 7038955.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C47 H40 Dy N3 O4 S2 |
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Calculated formula | C47 H40 Dy N3 O4 S2 |
SMILES | [Dy]1234([S]=C(S1)N(CC)CC)(OC(=CC(=[O]2)c1ccccc1)c1ccccc1)(OC(=CC(=[O]3)c1ccccc1)c1ccccc1)[n]1cccc2c1c1[n]4cccc1cc2 |
Title of publication | A distinct magnetic anisotropy enhancement in mononuclear dysprosium-sulfur complexes by controlling the Dy-ligand bond length. |
Authors of publication | Liu, Shan-Shan; Lang, Ke; Zhang, Yi-Quan; Yang, Qian; Wang, Bing-Wu; Gao, Song |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2016 |
Journal volume | 45 |
Journal issue | 19 |
Pages of publication | 8149 - 8153 |
a | 12.0684 ± 0.0003 Å |
b | 20.5775 ± 0.0005 Å |
c | 17.6455 ± 0.0005 Å |
α | 90° |
β | 106.988 ± 0.003° |
γ | 90° |
Cell volume | 4190.8 ± 0.2 Å3 |
Cell temperature | 180 ± 2 K |
Ambient diffraction temperature | 180 ± 2 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0359 |
Residual factor for significantly intense reflections | 0.0255 |
Weighted residual factors for significantly intense reflections | 0.0541 |
Weighted residual factors for all reflections included in the refinement | 0.06 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.055 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/7038955.html
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