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Information card for entry 2214268
Preview
Coordinates | 2214268.cif |
---|---|
Structure factors | 2214268.hkl |
Original IUCr paper | HTML |
Chemical name | catena-Poly[[bis(benzene-1,3-dicarboxylato-κ^2^O,O')zinc(II)]- μ-4,4'-bipyridine-κ^2^N:N'] |
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Formula | C26 H18 N2 O8 Zn |
Calculated formula | C26 H18 N2 O8 Zn |
SMILES | [Zn](OC(=O)c1cc(C(=O)O)ccc1)(OC(=O)c1cc(ccc1)C(=O)O)[n]1ccc(cc1)c1cc[n](cc1)[Zn](OC(=O)c1cc(C(=O)O)ccc1)(OC(=O)c1cc(ccc1)C(=O)O)[n]1ccc(c2ccncc2)cc1 |
Title of publication | <i>catena</i>-Poly[[bis(benzene-1,3-dicarboxylato-κ^2^<i>O</i>,<i>O</i>')zinc(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'] |
Authors of publication | Xiu-Mei Li; Yan-Hui Dong; Qing-Wei Wang; Bo Liu |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2007 |
Journal volume | 63 |
Journal issue | 7 |
Pages of publication | m1839 - m1840 |
a | 20.94 ± 0.003 Å |
b | 9.6078 ± 0.0012 Å |
c | 14.7942 ± 0.0019 Å |
α | 90° |
β | 125.884 ± 0.002° |
γ | 90° |
Cell volume | 2411.5 ± 0.6 Å3 |
Cell temperature | 292 ± 2 K |
Ambient diffraction temperature | 292 ± 2 K |
Number of distinct elements | 5 |
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 | 0.0371 |
Residual factor for significantly intense reflections | 0.0328 |
Weighted residual factors for significantly intense reflections | 0.0888 |
Weighted residual factors for all reflections included in the refinement | 0.0913 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.039 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | Yes |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2214268.html
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