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Information card for entry 2231876
Preview
Coordinates | 2231876.cif |
---|---|
Structure factors | 2231876.hkl |
Original IUCr paper | HTML |
Chemical name | Di-μ~3~-chlorido-tetra-μ~2~-chlorido-dichloridobis(dimethylformamide- κ<i>O</i>)hexakis(1<i>H</i>-imidazole-κ<i>N</i>^3^)tetracadmium |
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Formula | C24 H38 Cd4 Cl8 N14 O2 |
Calculated formula | C24 H38 Cd4 Cl8 N14 O2 |
SMILES | c1[n](cc[nH]1)[Cd]12([n]3c[nH]cc3)([O]=CN(C)C)[Cl]3[Cd]4(Cl)([n]5c[nH]cc5)([Cl][Cd]5([n]6c[nH]cc6)([n]6c[nH]cc6)([O]=CN(C)C)[Cl][Cd]3([n]3c[nH]cc3)([Cl]1)(Cl)[Cl]45)[Cl]2 |
Title of publication | Di-μ~3~-chlorido-tetra-μ~2~-chlorido-dichloridobis(dimethylformamide-κ<i>O</i>)hexakis(1<i>H</i>-imidazole-κ<i>N</i>^3^)tetracadmium |
Authors of publication | Zhu, Run-Qiang |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2011 |
Journal volume | 67 |
Journal issue | 10 |
Pages of publication | m1416 |
a | 8.254 ± 0.0017 Å |
b | 12.29 ± 0.003 Å |
c | 21.119 ± 0.004 Å |
α | 90° |
β | 99.23 ± 0.03° |
γ | 90° |
Cell volume | 2114.6 ± 0.8 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 | 0.0354 |
Residual factor for significantly intense reflections | 0.0281 |
Weighted residual factors for significantly intense reflections | 0.0667 |
Weighted residual factors for all reflections included in the refinement | 0.0694 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.046 |
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/2231876.html
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