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Information card for entry 2006125
Preview
| Coordinates | 2006125.cif |
|---|---|
| Original IUCr paper | HTML |
| Formula | C16 H40 Cl2 N4 O9 |
|---|---|
| Calculated formula | C16 H40 Cl2 N4 O9 |
| Title of publication | <i>meso</i>-5,5,7,12,12,14-Hexamethyl-1,4,8,11-tetraazacyclotetradecane Dihydroperchlorate Monohydrate |
| Authors of publication | Hu, Huai-Ming; Sun, Hong-Sui; Huang, Xiao-Ying; Chen, Xiao-Hua; Liu, Yonyjiang; You, Xiao-Zeng |
| Journal of publication | Acta Crystallographica Section C |
| Year of publication | 1997 |
| Journal volume | 53 |
| Journal issue | 5 |
| Pages of publication | 588 - 590 |
| a | 11.198 ± 0.002 Å |
| b | 8.836 ± 0.006 Å |
| c | 25.795 ± 0.007 Å |
| α | 90° |
| β | 98.34 ± 0.02° |
| γ | 90° |
| Cell volume | 2525.3 ± 1.9 Å3 |
| Cell temperature | 296 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 significantly intense reflections | 0.061 |
| Weighted residual factors for significantly intense reflections | 0.07 |
| Goodness-of-fit parameter for significantly intense reflections | 1.76 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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Users of the data should acknowledge the original authors of the
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