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CIF Information Card
Information card for 1100118
1100117 << 1100118 >> 1100119Preview
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Coordinates |
1100118.cif |
Structure parameters
| Chemical name | 1,4,8,11-Tetraazacyclodecane-1,4,8,11-tetraium bis(aquapentafluoroaluminate) dihydrate |
| Formula | - C10 H36 Al2 F10 N4 O4 - |
| Calculated formula | - C10 H36 Al2 F10 N4 O4 - |
| Title of publication | 1,4,8,11-Tetraazacyclodecane-1,4,8,11-tetraium bis(aquapentafluoroaluminate) dihydrate |
| Authors of publication | E. Goreshnik; M. Leblanc; V. Maisonneuve |
| Journal of publication | Acta Crystallographica, Section E |
| Year of publication | 2003 |
| Journal volume | 59 |
| Journal issue | 11 |
| Pages of publication | m1059 - m1061 |
| a | 8.493 ± 0.0008 Å |
| b | 8.932 ± 0.001 Å |
| c | 13.434 ± 0.002 Å |
| α | 90° |
| β | 97.141 ± 0.008° |
| γ | 90° |
| Cell volume | 1011.2 ± 0.2 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 6 |
| Hermann-Mauguin symmetry space group | P 1 21/n 1 |
| Hall symmetry space group | -P 2yn |
| Residual factor for all reflections | 0.1639 |
| Residual factor for observed reflections | 0.0632 |
| Weighted residual factors for the observed reflections | 0.1198 |
| Weighted residual factors for all reflections included in the refinement | 0.1508 |
| Goodness-of-fit parameter for observed reflections | 1.094 |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |