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Information card for entry 2232002
Preview
Coordinates | 2232002.cif |
---|---|
Structure factors | 2232002.hkl |
Original IUCr paper | HTML |
Chemical name | Di-μ-chlorido-bis{[1,2-bis(pyridin-2-ylmethoxy)benzene- κ^4^<i>N</i>,<i>O</i>,<i>O</i>',<i>N</i>']chloridocadmium} |
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Formula | C36 H32 Cd2 Cl4 N4 O4 |
Calculated formula | C36 H32 Cd2 Cl4 N4 O4 |
SMILES | c1cccc2C[O]3c4c([O]5Cc6[n](cccc6)[Cd]635([n]12)([Cl][Cd]123([n]5ccccc5C[O]2c2ccccc2[O]3Cc2[n]1cccc2)([Cl]6)Cl)Cl)cccc4 |
Title of publication | Di-μ-chlorido-bis{[1,2-bis(pyridin-2-ylmethoxy)benzene-κ^4^<i>N</i>,<i>O</i>,<i>O</i>',<i>N</i>']chloridocadmium} |
Authors of publication | Gao, Jin-Sheng; Yu, Ying-Hui; Liu, Ying; Hou, Guang-Feng |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2011 |
Journal volume | 67 |
Journal issue | 10 |
Pages of publication | m1415 |
a | 10.833 ± 0.002 Å |
b | 10.968 ± 0.002 Å |
c | 16.095 ± 0.003 Å |
α | 90° |
β | 109.14 ± 0.03° |
γ | 90° |
Cell volume | 1806.6 ± 0.7 Å3 |
Cell temperature | 293 ± 2 K |
Ambient diffraction temperature | 293 ± 2 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/c 1 |
Hall space group symbol | -P 2ybc |
Residual factor for all reflections | 0.0227 |
Residual factor for significantly intense reflections | 0.0194 |
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 | 1.053 |
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/2232002.html
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Users of the data should acknowledge the original authors of the
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