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Information card for entry 2221116
Preview
Coordinates | 2221116.cif |
---|---|
Structure factors | 2221116.hkl |
Original IUCr paper | HTML |
Chemical name | <i>catena</i>-Poly[[(pyridine-κ<i>N</i>)copper(II)]-μ~3~-pyridine-2,6- dicarboxylato-κ^3^<i>O</i>^2^:<i>O</i>^2'^,<i>N</i>,<i>O</i>^6^:<i>O</i>^6'^] |
---|---|
Formula | C12 H8 Cu N2 O4 |
Calculated formula | C12 H8 Cu N2 O4 |
SMILES | c1cccc[n]1[Cu]12OC(=O)c3cccc(C(=O)O2)[n]13 |
Title of publication | <i>catena</i>-Poly[[(pyridine-κ<i>N</i>)copper(II)]-μ~3~-pyridine-2,6-dicarboxylato-κ^3^<i>O</i>^2^:<i>O</i>^2'^,<i>N</i>,<i>O</i>^6^:<i>O</i>^6'^] |
Authors of publication | Trivedi, Manoj; Pandey, Daya Shankar; Rath, Nigam P. |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2009 |
Journal volume | 65 |
Journal issue | 3 |
Pages of publication | m303 - m304 |
a | 7.8042 ± 0.0009 Å |
b | 13.6152 ± 0.0017 Å |
c | 10.0667 ± 0.0012 Å |
α | 90° |
β | 91.687 ± 0.004° |
γ | 90° |
Cell volume | 1069.2 ± 0.2 Å3 |
Cell temperature | 100 ± 2 K |
Ambient diffraction temperature | 100 ± 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 | 0.0354 |
Residual factor for significantly intense reflections | 0.0294 |
Weighted residual factors for significantly intense reflections | 0.071 |
Weighted residual factors for all reflections included in the refinement | 0.0742 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.104 |
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/2221116.html
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Users of the data should acknowledge the original authors of the
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