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Information card for entry 2212901
Preview
Coordinates | 2212901.cif |
---|---|
Structure factors | 2212901.hkl |
Original IUCr paper | HTML |
Chemical name | trans-Bis[(2E)-3-(N,N-dimethylamino)-1-(2-pyridyl)prop-2-en-1-one- k^2^N,O]bis(perchlorato-κO)cadmium(II) |
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Formula | C20 H24 Cd Cl2 N4 O10 |
Calculated formula | C20 H24 Cd Cl2 N4 O10 |
SMILES | c1cccc2[n]1[Cd]1([n]3ccccc3C(/C=C/N(C)C)=[O]1)([O]=C2/C=C/N(C)C)(OCl(=O)(=O)=O)OCl(=O)(=O)=O |
Title of publication | <i>trans</i>-Bis[(2<i>E</i>)-3-(<i>N</i>,<i>N</i>-dimethylamino)-1-(2-pyridyl)prop-2-en-1-one-κ^2^<i>N</i>,<i>O</i>]bis(perchlorato-κ<i>O</i>)cadmium(II) |
Authors of publication | Tong-Liang Hu; Jin-Lei Tian |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2007 |
Journal volume | 63 |
Journal issue | 4 |
Pages of publication | m1092 - m1093 |
a | 7.3648 ± 0.0019 Å |
b | 9.3606 ± 0.0019 Å |
c | 9.839 ± 0.002 Å |
α | 78.656 ± 0.003° |
β | 79.377 ± 0.003° |
γ | 71.775 ± 0.002° |
Cell volume | 626.2 ± 0.2 Å3 |
Cell temperature | 298 ± 2 K |
Ambient diffraction temperature | 298 ± 2 K |
Number of distinct elements | 6 |
Space group number | 2 |
Hermann-Mauguin space group symbol | P -1 |
Hall space group symbol | -P 1 |
Residual factor for all reflections | 0.0332 |
Residual factor for significantly intense reflections | 0.0324 |
Weighted residual factors for significantly intense reflections | 0.0855 |
Weighted residual factors for all reflections included in the refinement | 0.0863 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.038 |
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/2212901.html
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Users of the data should acknowledge the original authors of the
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