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Information card for entry 1563391
Preview
Coordinates | 1563391.cif |
---|---|
Original paper (by DOI) | HTML |
Formula | C38 H50 N8 O21 S2 W6 |
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Calculated formula | C38 H50 N8 O21 S2 W6 |
SMILES | c12[s+]c3cc(ccc3nc1ccc(N(C)C)c2)N(C)C.N(C)(C=O)C.O1[W]234(O[W]567([O]89%102[W]2%11(O[W]9(O5)(=O)(O3)O[W]%10(O[W]18(=O)(O%11)O7)(O2)(=O)O4)(O6)=O)=O)=O.c1(cc2[s+]c3c(ccc(N(C)C)c3)nc2cc1)N(C)C.N(C)(C)C=O |
Title of publication | Two inorganic‒organic hybrid materials based on polyoxometalate anions and methylene blue: Preparations, crystal structures and properties |
Authors of publication | Nie, Shanshan; Zhang, Yaobin; Liu, Bin; Li, Zuoxi; Hu, Huaiming; Xue, Ganglin; Fu, Feng; Wang, Jiwu |
Journal of publication | Journal of Solid State Chemistry |
Year of publication | 2010 |
Journal volume | 183 |
Journal issue | 12 |
Pages of publication | 2957 - 2962 |
a | 10.368 ± 0.0018 Å |
b | 11.703 ± 0.002 Å |
c | 12.164 ± 0.002 Å |
α | 89.777 ± 0.002° |
β | 65.197 ± 0.002° |
γ | 79.206 ± 0.002° |
Cell volume | 1311.5 ± 0.4 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 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 | 0.0616 |
Residual factor for significantly intense reflections | 0.0499 |
Weighted residual factors for significantly intense reflections | 0.1315 |
Weighted residual factors for all reflections included in the refinement | 0.1542 |
Goodness-of-fit parameter for all reflections included in the refinement | 0.988 |
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/1563391.html
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Users of the data should acknowledge the original authors of the
structural data.