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Information card for entry 2207405
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Coordinates | 2207405.cif |
---|---|
Original IUCr paper | HTML |
Chemical name | catena-Poly[[diaqua(1,10-phenanthroline-κ^2^N,N')cadmium(II)]-μ- fumarato-κ^2^O:O'] |
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Formula | C16 H14 Cd N2 O6 |
Calculated formula | C16 H14 Cd N2 O6 |
SMILES | [Cd]1([OH2])([OH2])([n]2cccc3ccc4ccc[n]1c4c23)OC(=O)/C=C/C(=O)O[Cd]2(OC(=O)/C=C/C(=O)[O-])([OH2])([OH2])[n]3cccc4ccc5ccc[n]2c5c34 |
Title of publication | <i>catena</i>-Poly[[diaqua(1,10-phenanthroline-κ^2^<i>N</i>,<i>N</i>')cadmium(II)]-μ-fumarato-κ^2^<i>O</i>:<i>O</i>'] |
Authors of publication | Sun, Ya-Guang; Gao, En-Jun; Liu, Xia; Wang, Cheng-Shen |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2005 |
Journal volume | 61 |
Journal issue | 11 |
Pages of publication | m2190 - m2191 |
a | 11.76 ± 0.009 Å |
b | 13.06 ± 0.01 Å |
c | 11.243 ± 0.009 Å |
α | 90° |
β | 114.92 ± 0.01° |
γ | 90° |
Cell volume | 1566 ± 2 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 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 | 0.025 |
Residual factor for significantly intense reflections | 0.02 |
Weighted residual factors for significantly intense reflections | 0.047 |
Weighted residual factors for all reflections included in the refinement | 0.048 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.04 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/2207405.html
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