Information card for entry 2219674
| Chemical name |
Bis(2,4,6-triamino-1,3,5-triazin-1-ium) tris(pyridine-2,6-dicarboxylato)zirconate(IV) tetrahydrate |
| Formula |
C27 H31 N15 O16 Zr |
| Calculated formula |
C27 H31 N15 O16 Zr |
| Title of publication |
Bis(2,4,6-triamino-1,3,5-triazin-1-ium) tris(pyridine-2,6-dicarboxylato)zirconate(IV) tetrahydrate |
| Authors of publication |
Daneshvar, Shirin; Aghabozorg, Hossein; Manteghi, Faranak |
| Journal of publication |
Acta Crystallographica Section E |
| Year of publication |
2008 |
| Journal volume |
64 |
| Journal issue |
10 |
| Pages of publication |
m1308 - m1309 |
| a |
9.3749 ± 0.0016 Å |
| b |
12.308 ± 0.003 Å |
| c |
16.934 ± 0.004 Å |
| α |
97.926 ± 0.019° |
| β |
106.05 ± 0.012° |
| γ |
107.839 ± 0.011° |
| Cell volume |
1733.8 ± 0.7 Å3 |
| Cell temperature |
120 ± 2 K |
| Ambient diffraction temperature |
120 ± 2 K |
| Number of distinct elements |
5 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.0503 |
| Residual factor for significantly intense reflections |
0.0407 |
| Weighted residual factors for significantly intense reflections |
0.099 |
| Weighted residual factors for all reflections included in the refinement |
0.1039 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
Yes |
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https://www.crystallography.net/2219674.html
