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Information card for entry 7054678
Preview
Coordinates | 7054678.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C29 H28 F12 N5 Ni O11 Tb |
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Calculated formula | C29 H28 F12 N5 Ni O11 Tb |
SMILES | c12c3cccc1C=[N]1CCC[N]4=Cc5cccc6c5[O]5[Ni]14(N=N#N)([O]2[Tb]125([O]3C)([O]6C)([O]=C(C(F)(F)F)C=C(C(F)(F)F)O1)([O]=C(C(F)(F)F)C=C(C(F)(F)F)O2)[OH2])[OH2].O |
Title of publication | Synthesis, structures and magnetism of heterodinuclear Ni‒Ln complexes: field-induced single-molecule magnet behavior in the dysprosium analogue |
Authors of publication | Lu, Xing-Yun; Liu, Yu-Qing; Deng, Xiao-Wei; Zhu, Zhao-Xia; Yao, Min-Xia; Jing, Su |
Journal of publication | New J. Chem. |
Year of publication | 2015 |
Journal volume | 39 |
Journal issue | 5 |
Pages of publication | 3467 |
a | 17.8821 ± 0.0014 Å |
b | 10.8892 ± 0.0011 Å |
c | 20.0534 ± 0.0018 Å |
α | 90° |
β | 106.038 ± 0.002° |
γ | 90° |
Cell volume | 3752.9 ± 0.6 Å3 |
Cell temperature | 153 ± 2 K |
Ambient diffraction temperature | 153 ± 2 K |
Number of distinct elements | 7 |
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 | 0.0603 |
Residual factor for significantly intense reflections | 0.0543 |
Weighted residual factors for significantly intense reflections | 0.133 |
Weighted residual factors for all reflections included in the refinement | 0.1336 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.086 |
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/7054678.html
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