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Information card for entry 2019582
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| Coordinates | 2019582.cif |
|---|---|
| Structure factors | 2019582.hkl |
| Original IUCr paper | HTML |
| Chemical name | Poly[[μ~4~-(<i>E</i>)-2,2'-(diazene-1,2-diyl)dibenzoato]dimethanollead(II)] |
|---|---|
| Formula | C16 H16 N2 O6 Pb |
| Calculated formula | C16 H16 N2 O6 Pb |
| SMILES | C(=O)(c1ccccc1N=Nc1c(C(=O)[O-])cccc1)[O-].CO.[Pb+2].CO |
| Title of publication | A three-dimensional Pb^II^ coordination framework: poly[[μ~4~-(<i>E</i>)-2,2'-(diazene-1,2-diyl)dibenzoato]dimethanollead(II)] |
| Authors of publication | Liu, Lei-Lei; Yu, Cai-Xia; Hua, Lei; Lin, Lu |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 2014 |
| Journal volume | 70 |
| Journal issue | 7 |
| Pages of publication | 650 - 653 |
| a | 20.508 ± 0.004 Å |
| b | 10.899 ± 0.002 Å |
| c | 8.2818 ± 0.0017 Å |
| α | 90° |
| β | 109.9 ± 0.03° |
| γ | 90° |
| Cell volume | 1740.6 ± 0.7 Å3 |
| Cell temperature | 296 ± 2 K |
| Ambient diffraction temperature | 296 ± 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 | 0.0318 |
| Residual factor for significantly intense reflections | 0.0277 |
| Weighted residual factors for significantly intense reflections | 0.0638 |
| Weighted residual factors for all reflections included in the refinement | 0.0665 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.053 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181865 (current) | 2016-04-06 | hkl/2/01/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/01/95. |
2019582.cif 2019582.hkl |
| 180863 | 2016-04-02 | cif/2/01/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/01/95. |
2019582.cif 2019582.hkl |
| 176760 | 2016-02-20 | cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/01. |
2019582.cif 2019582.hkl |
| 121394 | 2014-08-06 | cif/ Updating files of 2019582 Original log message: Adding full bibliography for 2019582.cif. |
2019582.cif 2019582.hkl |
| 116122 | 2014-06-07 | cif/ hkl/ Adding structures of 2019582 via cif-deposit CGI script. |
2019582.cif 2019582.hkl |
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