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Information card for entry 7112808
Preview
Coordinates | 7112808.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C26 H68 Cr Cu2 N8 O32 Tb |
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Calculated formula | C26 H36 Cr Cu2 N8 O32 Tb |
SMILES | C1CC[NH]2CC[NH]3CCCN4[Cu]23N1C1C4=[O][Tb]23([O]=1)([O]=C1O[Cr]45(OC1=[O]3)(OC(=O)C(=O)O4)OC(=O)C(=O)O5)([OH2])([O]=C1C(N3[Cu]45[NH](CC[NH]4CCCN15)CCC3)=[O]2)[OH2].O.O.O.O.O.O.O.O.O.O.O.O.O.O |
Title of publication | Multi-component synthesis of trimetallic tetranuclear clusters [Cu(L)(H(2)O)](2)Ln(H(2)O)(2)Cr(C(2)O(4))(3).12H(2)O (H(2)L = 1,4,8,11-tetraazacyclotradecane-2,3-dione, Ln(3+) = Gd, Tb and Dy). |
Authors of publication | Kou, Hui-Zhong; Hu, Kong-Qiu; Zhao, Hao-Yan; Tang, Junkui; Cui, Ai-Li |
Journal of publication | Chemical communications (Cambridge, England) |
Year of publication | 2010 |
Journal volume | 46 |
Journal issue | 35 |
Pages of publication | 6533 - 6535 |
a | 18.7089 ± 0.0018 Å |
b | 16.3018 ± 0.0016 Å |
c | 16.9124 ± 0.0014 Å |
α | 90° |
β | 100.505 ± 0.003° |
γ | 90° |
Cell volume | 5071.6 ± 0.8 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 7 |
Space group number | 15 |
Hermann-Mauguin space group symbol | C 1 2/c 1 |
Hall space group symbol | -C 2yc |
Residual factor for all reflections | 0.1197 |
Residual factor for significantly intense reflections | 0.0637 |
Weighted residual factors for significantly intense reflections | 0.1341 |
Weighted residual factors for all reflections included in the refinement | 0.1901 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.098 |
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/7112808.html
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