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Information card for entry 2238643
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Coordinates | 2238643.cif |
---|---|
Original IUCr paper | HTML |
Chemical name | Dibromidobis(2-methyl-1<i>H</i>-benzimidazole-κ<i>N</i>^3^)cadmium |
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Formula | C16 H16 Br2 Cd N4 |
Calculated formula | C16 H16 Br2 Cd N4 |
SMILES | [n]1(c2c([nH]c1C)cccc2)[Cd]([n]1c2ccccc2[nH]c1C)(Br)Br |
Title of publication | Dibromidobis(2-methyl-1<i>H</i>-benzimidazole-κ<i>N</i>^3^)cadmium |
Authors of publication | Liu, Bao-Cheng; Jin, Yan-Ling; Liu, Fa-Qian |
Journal of publication | Acta Crystallographica Section E |
Year of publication | 2013 |
Journal volume | 69 |
Journal issue | 10 |
Pages of publication | m536 |
a | 10.007 ± 0.009 Å |
b | 14.747 ± 0.012 Å |
c | 12.399 ± 0.011 Å |
α | 90° |
β | 93.088 ± 0.014° |
γ | 90° |
Cell volume | 1827 ± 3 Å3 |
Cell temperature | 296 ± 2 K |
Ambient diffraction temperature | 296 ± 2 K |
Number of distinct elements | 5 |
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 | 0.0494 |
Residual factor for significantly intense reflections | 0.0328 |
Weighted residual factors for significantly intense reflections | 0.0729 |
Weighted residual factors for all reflections included in the refinement | 0.0767 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.001 |
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/2238643.html
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