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Information card for entry 2231718
Preview
Coordinates | 2231718.cif |
---|---|
Structure factors | 2231718.hkl |
Original IUCr paper | HTML |
Chemical name | <i>catena</i>-Poly[[bis(<i>N</i>,<i>N</i>-dimethylformamide-κ<i>O</i>)zinc]- μ~2~-oxalato-κ^4^<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^1'^,<i>O</i>^2'^] |
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Formula | C8 H14 N2 O6 Zn |
Calculated formula | C8 H14 N2 O6 Zn |
SMILES | [Zn]1([O]=CN(C)C)([O]=CN(C)C)[O]=C2C(O1)=O[Zn]1(O2)([O]=CN(C)C)([O]=CN(C)C)OC(=O)C(=O)O1 |
Title of publication | <i>catena</i>-Poly[[bis(<i>N</i>,<i>N</i>-dimethylformamide-κ<i>O</i>)zinc]-μ~2~-oxalato-κ^4^<i>O</i>^1^,<i>O</i>^2^:<i>O</i>^1'^,<i>O</i>^2'^] |
Authors of publication | Lee, Ju Eun; Lee, Hong-In |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2011 |
Journal volume | 67 |
Journal issue | 9 |
Pages of publication | m1172 |
a | 7.795 ± 0.001 Å |
b | 9.809 ± 0.001 Å |
c | 15.421 ± 0.001 Å |
α | 90° |
β | 90° |
γ | 90° |
Cell volume | 1179.1 ± 0.2 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 K |
Number of distinct elements | 5 |
Space group number | 60 |
Hermann-Mauguin space group symbol | P b n a |
Hall space group symbol | -P 2ac 2b |
Residual factor for all reflections | 0.0592 |
Residual factor for significantly intense reflections | 0.0577 |
Weighted residual factors for significantly intense reflections | 0.1642 |
Weighted residual factors for all reflections included in the refinement | 0.1688 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.092 |
Diffraction radiation wavelength | 0.9 Å |
Diffraction radiation type | Synchrotron |
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/2231718.html
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Users of the data should acknowledge the original authors of the
structural data.