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Information card for entry 2205337
Preview
Coordinates | 2205337.cif |
---|---|
Structure factors | 2205337.hkl |
Original IUCr paper | HTML |
Chemical name | catena-Poly[[cis-diaqua(2,2'-bipyridine)cobalt(II)]-μ-3-carboxylato-4- hydroxybenzenesulfonato] |
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Formula | C17 H16 Co N2 O8 S |
Calculated formula | C17 H16 Co N2 O8 S |
SMILES | [Co]1(OC(=O)c2c(O)ccc(S(=O)(=O)[O-])c2)([OH2])([OH2])([n]2ccccc2c2[n]1cccc2)OS(=O)(=O)c1ccc(O)c(C(=O)O[Co]2([n]3c(c4[n]2cccc4)cccc3)([OH2])[OH2])c1 |
Title of publication | <i>catena</i>-Poly[[<i>cis</i>-diaqua(2,2'-bipyridine)cobalt(II)]-μ-3-carboxylato-4-hydroxybenzenesulfonato] |
Authors of publication | Fan, Sai-Rong; Zhu, Long-Guan; Xiao, Hong-Ping; Ng, Seik Weng |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2005 |
Journal volume | 61 |
Journal issue | 3 |
Pages of publication | m435 - m436 |
a | 14.425 ± 0.001 Å |
b | 7.6138 ± 0.0005 Å |
c | 18.129 ± 0.001 Å |
α | 90° |
β | 111.776 ± 0.001° |
γ | 90° |
Cell volume | 1849 ± 0.2 Å3 |
Cell temperature | 295 ± 2 K |
Ambient diffraction temperature | 295 ± 2 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.074 |
Residual factor for significantly intense reflections | 0.072 |
Weighted residual factors for significantly intense reflections | 0.167 |
Weighted residual factors for all reflections included in the refinement | 0.168 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.34 |
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/2205337.html
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