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Information card for entry 2211213
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| Coordinates | 2211213.cif |
|---|---|
| Structure factors | 2211213.hkl |
| Original IUCr paper | HTML |
| Chemical name | catena-Poly[[(5-bromopyridine-3-carboxylato-κ^2^O,O')dibutyltin(IV)]- μ-5-bromopyridine-3-carboxylato-κ^2^O,O':κN] |
|---|---|
| Formula | C20 H24 Br2 N2 O4 Sn |
| Calculated formula | C20 H24 Br2 N2 O4 Sn |
| SMILES | C(=O)(c1cncc(c1)Br)O[Sn]1(CCCC)(CCCC)OC(=[O]1)c1cncc(Br)c1 |
| Title of publication | <i>catena</i>-Poly[[(5-bromopyridine-3-carboxylato-κ^2^<i>O</i>,<i>O</i>')dibutyltin(IV)]-μ-5-bromopyridine-3-carboxylato-κ^2^<i>O</i>,<i>O</i>':κ<i>N</i>] |
| Authors of publication | Zhong-Jun Gao; Reng-Zhou Shi |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2006 |
| Journal volume | 62 |
| Journal issue | 11 |
| Pages of publication | m2995 - m2996 |
| a | 8.068 ± 0.002 Å |
| b | 10.044 ± 0.003 Å |
| c | 15.158 ± 0.004 Å |
| α | 76.001 ± 0.004° |
| β | 80.659 ± 0.004° |
| γ | 79.932 ± 0.004° |
| Cell volume | 1164.2 ± 0.5 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 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 | 0.05 |
| Residual factor for significantly intense reflections | 0.035 |
| Weighted residual factors for significantly intense reflections | 0.083 |
| Weighted residual factors for all reflections included in the refinement | 0.091 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1 |
| 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/2211213.html
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Users of the data should acknowledge the original authors of the
structural data.