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Information card for entry 4324422
Preview
Coordinates | 4324422.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C44 H63 Cl N6 Ni2 O25 S2 Tb2 |
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Calculated formula | C44 H63 Cl N6 Ni2 O25 S2 Tb2 |
SMILES | [Tb]1234([OH]5[Ni]678([N](Nc9sc%10ccccc%10[n]69)=Cc6c([O]17[Ni]179%10[OH]4[Tb]45([O]8%10c8c([O]4C)cccc8C=[N]1Nc1sc8ccccc8[n]71)(OC(=O)C)([O]=C(O9)C)([OH]C)O)c([O]2C)ccc6)[O]=C(O3)C)(OC(=O)C)([OH]C)[OH]C.Cl(=O)(=O)(=O)[O-].OC.OC.OC |
Title of publication | Heterometallic Cubanes: Syntheses, Structures, and Magnetic Properties of Lanthanide(III)-Nickel(II) Architectures |
Authors of publication | Yajie Gao; Lang Zhao; Xuebin Xu; Gong-Feng Xu; Yun-Nan Guo; Jinkui Tang; Zhiliang Liu |
Journal of publication | Inorganic Chemistry |
Year of publication | 2011 |
Journal volume | 50 |
Pages of publication | 1304 - 1308 |
a | 14.38 ± 0.0006 Å |
b | 26.6616 ± 0.0011 Å |
c | 14.9053 ± 0.0006 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 5714.6 ± 0.4 Å3 |
Cell temperature | 186 ± 2 K |
Ambient diffraction temperature | 186 ± 2 K |
Number of distinct elements | 8 |
Space group number | 33 |
Hermann-Mauguin space group symbol | P n a 21 |
Hall space group symbol | P 2c -2n |
Residual factor for all reflections | 0.0434 |
Residual factor for significantly intense reflections | 0.034 |
Weighted residual factors for significantly intense reflections | 0.0725 |
Weighted residual factors for all reflections included in the refinement | 0.0868 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.073 |
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/4324422.html
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