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Information card for entry 2209257
Preview
Coordinates | 2209257.cif |
---|---|
Structure factors | 2209257.hkl |
Original IUCr paper | HTML |
Chemical name | catena-Poly[[diaquabis[(4-tolylsulfanyl)acetato-κO]cobalt(II)]-μ-4,4'- bipyridine-κ^2^N:N'] |
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Formula | C28 H30 Co N2 O6 S2 |
Calculated formula | C28 H30 Co N2 O6 S2 |
SMILES | [Co](OC(=O)CSc1ccc(cc1)C)([OH2])(OC(=O)CSc1ccc(cc1)C)([OH2])([n]1ccc(cc1)c1cc[n](cc1)[Co](OC(=O)CSc2ccc(C)cc2)(OC(=O)CSc2ccc(cc2)C)([OH2])[OH2])[n]1ccc(c2ccncc2)cc1 |
Title of publication | <i>catena</i>-Poly[[diaquabis[(4-tolylsulfanyl)acetato-κ<i>O</i>]cobalt(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'] |
Authors of publication | Xiao-Yong Zheng; Hong Su; Yun-Long Feng |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2006 |
Journal volume | 62 |
Journal issue | 6 |
Pages of publication | m1393 - m1394 |
a | 21.684 ± 0.004 Å |
b | 11.376 ± 0.002 Å |
c | 11.032 ± 0.002 Å |
α | 90° |
β | 92.828 ± 0.003° |
γ | 90° |
Cell volume | 2718 ± 0.9 Å3 |
Cell temperature | 273 ± 2 K |
Ambient diffraction temperature | 273 ± 2 K |
Number of distinct elements | 6 |
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 | 0.0364 |
Residual factor for significantly intense reflections | 0.0282 |
Weighted residual factors for significantly intense reflections | 0.0787 |
Weighted residual factors for all reflections included in the refinement | 0.0811 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.077 |
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/2209257.html
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