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Information card for entry 2208276
Preview
Coordinates | 2208276.cif |
---|---|
Structure factors | 2208276.hkl |
Original IUCr paper | HTML |
Chemical name | catena-Poly[[aqua(4,4'-dimethyl-2,2'-bipyridine)copper(II)]-μ-fumarato] |
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Formula | C16 H16 Cu N2 O5 |
Calculated formula | C16 H16 Cu N2 O5 |
SMILES | [Cu]1([OH2])([n]2c(c3[n]1ccc(c3)C)cc(cc2)C)OC(=O)/C=C/C(=O)O[Cu]1([OH2])([n]2c(c3[n]1ccc(c3)C)cc(cc2)C)OC(=O)/C=C/C(=O)[O-] |
Title of publication | <i>catena</i>-Poly[[aqua(4,4'-dimethyl-2,2'-bipyridine)copper(II)]-μ-fumarato-κ^2^<i>O</i>,<i>O</i>':κ^2^<i>O</i>'',<i>O</i>'''-[aqua(4,4'-dimethyl-2,2'-bipyridine)copper(II)]-μ-fumarato-κ<i>O</i>:κ<i>O</i>'] |
Authors of publication | Dong, Gui-Ying; Cui, Guang-Hua; Lin, Jin |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2006 |
Journal volume | 62 |
Journal issue | 3 |
Pages of publication | m628 - m630 |
a | 7.337 ± 0.003 Å |
b | 10.767 ± 0.005 Å |
c | 10.967 ± 0.005 Å |
α | 93.602 ± 0.007° |
β | 104.926 ± 0.007° |
γ | 104.64 ± 0.007° |
Cell volume | 802.3 ± 0.6 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 293 ± 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 | 0.0438 |
Residual factor for significantly intense reflections | 0.0389 |
Weighted residual factors for significantly intense reflections | 0.1002 |
Weighted residual factors for all reflections included in the refinement | 0.1031 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.035 |
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/2208276.html
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