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Information card for entry 7038954
Preview
Coordinates | 7038954.cif |
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Original paper (by DOI) | HTML |
Formula | C27 H38 Dy N5 S6 |
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Calculated formula | C27 H38 Dy N5 S6 |
SMILES | [Dy]1234([S]=C(S1)N(CC)CC)([S]=C(S3)N(CC)CC)([S]=C(S2)N(CC)CC)[n]1c2c(ccc1)ccc1ccc[n]4c21 |
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 | 16.9255 ± 0.0006 Å |
b | 10.5467 ± 0.0004 Å |
c | 18.5084 ± 0.0004 Å |
α | 90° |
β | 97.055 ± 0.002° |
γ | 90° |
Cell volume | 3278.89 ± 0.18 Å3 |
Cell temperature | 110 ± 10 K |
Ambient diffraction temperature | 110 ± 10 K |
Number of distinct elements | 5 |
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 | 0.0413 |
Residual factor for significantly intense reflections | 0.0312 |
Weighted residual factors for significantly intense reflections | 0.0673 |
Weighted residual factors for all reflections included in the refinement | 0.0723 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.999 |
Diffraction radiation wavelength | 1.54184 Å |
Diffraction radiation type | CuKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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