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Information card for entry 7704641
Preview
Coordinates | 7704641.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C40 H46 Cl2 Dy2 N4 O13 |
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Calculated formula | C40 H46 Cl2 Dy2 N4 O13 |
SMILES | [Dy]123456([O]7[Dy]89([O]1c1c(cccc1[O]8C)C[N]6=Cc1c(O3)cc(Cl)cc1)(Oc1cc(Cl)ccc1C=[N]9Cc1c7c([O]2C)ccc1)([O]=C(O4)C)OC(=O)C)ON(=O)=[O]5.[NH+](CC)(CC)CC |
Title of publication | Designing asymmetric Dy<sub>2</sub> single-molecule magnets with two-step relaxation processes by the modification of the coordination environments of Dy(iii) ions. |
Authors of publication | Huang, Yuan; Li, Jia-Xin; Ge, Yu; Zhang, Xia-Mei; Xu, Yang; Li, Yahong; Zhang, Yi-Quan; Yao, Jin-Lei |
Journal of publication | Dalton transactions (Cambridge, England : 2003) |
Year of publication | 2020 |
Journal volume | 49 |
Journal issue | 26 |
Pages of publication | 8976 - 8984 |
a | 9.9104 ± 0.0005 Å |
b | 13.649 ± 0.0007 Å |
c | 17.3574 ± 0.0009 Å |
α | 99.61 ± 0.002° |
β | 106.439 ± 0.002° |
γ | 94.958 ± 0.002° |
Cell volume | 2198 ± 0.2 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296.15 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0419 |
Residual factor for significantly intense reflections | 0.0277 |
Weighted residual factors for significantly intense reflections | 0.0607 |
Weighted residual factors for all reflections included in the refinement | 0.0653 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.069 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/7704641.html
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Users of the data should acknowledge the original authors of the
structural data.