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Information card for entry 2205222
Preview
| Coordinates | 2205222.cif |
|---|---|
| Original IUCr paper | HTML |
| Chemical name | Trimethylenetetraaminium(4+) bis(sulfate) monohydrate |
|---|---|
| Formula | C6 H24 N4 O9 S2 |
| Calculated formula | C6 H24 N4 O9 S2 |
| Title of publication | Triethylenetetraminium(4+) bis(sulfate) monohydrate |
| Authors of publication | Fu, Yun-Long; Xu, Zhi-Wei; Ren, Jia-Lin; Ng, Seik Weng |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2005 |
| Journal volume | 61 |
| Journal issue | 3 |
| Pages of publication | o774 - o775 |
| a | 6.3192 ± 0.0008 Å |
| b | 22.253 ± 0.003 Å |
| c | 5.4903 ± 0.0007 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 772.05 ± 0.17 Å3 |
| Cell temperature | 295 ± 2 K |
| Ambient diffraction temperature | 295 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 58 |
| Hermann-Mauguin space group symbol | P n n m |
| Hall space group symbol | -P 2 2n |
| Residual factor for all reflections | 0.081 |
| Residual factor for significantly intense reflections | 0.07 |
| Weighted residual factors for significantly intense reflections | 0.174 |
| Weighted residual factors for all reflections included in the refinement | 0.185 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.14 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | No |
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