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Information card for entry 2219058
Preview
| Coordinates | 2219058.cif |
|---|---|
| Structure factors | 2219058.hkl |
| Original IUCr paper | HTML |
| Chemical name | <i>catena</i>-Poly[μ-aqua-2:1'κ^2^O:O-aqua-2κO-(2-fluorobenzoato- 1κ^2^<i>O</i>,<i>O</i>')(μ~2~-2-fluorobenzoato- 2':1κ^2^<i>O</i>:<i>O</i>')bis(μ~3~-2-fluorobenzoato)- 2':1:2κ^4^O:O,O':O';1:2:1'κ^5^F,O:O,O':O'-dilead(II)] |
|---|---|
| Formula | C14 H10 F2 O5 Pb |
| Calculated formula | C14 H10 F2 O5 Pb |
| SMILES | [Pb+2].Fc1c(C(=O)[O-])cccc1.Fc1c(cccc1)C(=O)[O-].O |
| Title of publication | <i>catena</i>-Poly[μ-aqua-2:1'κ^2^<i>O</i>:<i>O</i>-aqua-2κ<i>O</i>-(2-fluorobenzoato-1κ^2^<i>O</i>,<i>O</i>')(μ~2~-2-fluorobenzoato-2':1κ^2^<i>O</i>:<i>O</i>')bis(μ~3~-2-fluorobenzoato)-2':1:2κ^4^<i>O</i>:<i>O</i>,<i>O</i>':<i>O</i>';1:2:1'κ^5^<i>F</i>,<i>O</i>:<i>O</i>,<i>O</i>':<i>O</i>'-dilead(II)] |
| Authors of publication | Zhang, Bi-Song |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2008 |
| Journal volume | 64 |
| Journal issue | 8 |
| Pages of publication | m1055 - m1056 |
| a | 7.1016 ± 0.0014 Å |
| b | 14.794 ± 0.003 Å |
| c | 15.096 ± 0.003 Å |
| α | 111.56 ± 0.03° |
| β | 95.32 ± 0.03° |
| γ | 97.31 ± 0.03° |
| Cell volume | 1446.2 ± 0.6 Å3 |
| Cell temperature | 290 ± 2 K |
| Ambient diffraction temperature | 290 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for all reflections | 0.0487 |
| Residual factor for significantly intense reflections | 0.0375 |
| Weighted residual factors for significantly intense reflections | 0.0885 |
| Weighted residual factors for all reflections included in the refinement | 0.0939 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.034 |
| 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/2219058.html
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