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Information card for entry 8105304
Preview
Coordinates | 8105304.cif |
---|---|
Original paper (by DOI) | HTML |
Chemical name | rac-<i>trans</i>-<i>N</i>,<i>N</i>'-bis(3-bromo-5-chlorosalicylidene)-1,2-\ cyclohexanediamine |
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Formula | C20 H18 Br2 Cl2 N2 O2 |
Calculated formula | C20 H18 Br2 Cl2 N2 O2 |
Title of publication | Crystal structure of rac-trans-N,N′-bis(3-bromo-5-chlorosalicylidene)-1,2-cyclohexanediamine, C20H18Br2Cl2N2O2 |
Authors of publication | Jiang, Fang; Xu, Yan; Ma, Xun; Li, Jiayi; Wu, Qiong |
Journal of publication | Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication | 2020 |
Journal volume | 235 |
Journal issue | 4 |
Pages of publication | 845 - 846 |
a | 10.6105 ± 0.0008 Å |
b | 17.1664 ± 0.0009 Å |
c | 11.9848 ± 0.0009 Å |
α | 90° |
β | 97.682 ± 0.003° |
γ | 90° |
Cell volume | 2163.4 ± 0.3 Å3 |
Cell temperature | 273 ± 2 K |
Ambient diffraction temperature | 273.15 K |
Number of distinct elements | 6 |
Space group number | 14 |
Hermann-Mauguin space group symbol | P 1 21/n 1 |
Hall space group symbol | -P 2yn |
Residual factor for all reflections | 0.0579 |
Residual factor for significantly intense reflections | 0.033 |
Weighted residual factors for significantly intense reflections | 0.0644 |
Weighted residual factors for all reflections included in the refinement | 0.0823 |
Goodness-of-fit parameter for all reflections included in the refinement | 1.1 |
Diffraction radiation wavelength | 0.71073 Å |
Diffraction radiation type | MoKα |
Has coordinates | Yes |
Has disorder | No |
Has Fobs | No |
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The link is: https://www.crystallography.net/8105304.html
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