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Information card for entry 2231921
Preview
Coordinates | 2231921.cif |
---|---|
Structure factors | 2231921.hkl |
Original IUCr paper | HTML |
Chemical name | <i>catena</i>-Poly[[bis(3-methylbenzoato-κ^2^<i>O</i>,<i>O</i>')lead(II)]- μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'] |
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Formula | C26 H22 N2 O4 Pb |
Calculated formula | C26 H22 N2 O4 Pb |
SMILES | [Pb]12([O]=C(c3cc(ccc3)C)O1)([O]=C(c1cc(ccc1)C)O2)[n]1ccc(cc1)c1cc[n](cc1)[Pb]12([O]=C(c3cc(ccc3)C)O1)([O]=C(c1cc(ccc1)C)O2)[n]1ccc(cc1)c1ccncc1 |
Title of publication | <i>catena</i>-Poly[[bis(3-methylbenzoato-κ^2^<i>O</i>,<i>O</i>')lead(II)]-μ-4,4'-bipyridine-κ^2^<i>N</i>:<i>N</i>'] |
Authors of publication | Xie, Jian-Ying; Huang, Fu |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2011 |
Journal volume | 67 |
Journal issue | 10 |
Pages of publication | m1326 |
a | 20.506 ± 0.008 Å |
b | 5.534 ± 0.002 Å |
c | 20.219 ± 0.008 Å |
α | 90° |
β | 103.507 ± 0.007° |
γ | 90° |
Cell volume | 2231 ± 1.5 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 | 0.0206 |
Residual factor for significantly intense reflections | 0.0169 |
Weighted residual factors for significantly intense reflections | 0.0401 |
Weighted residual factors for all reflections included in the refinement | 0.0418 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.012 |
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/2231921.html
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Users of the data should acknowledge the original authors of the
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