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Information card for entry 2202619
Preview
| Coordinates | 2202619.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Formula | C10 H36 Al2 F10 N4 O4 |
|---|---|
| Calculated formula | C10 H36 Al2 F10 N4 O4 |
| SMILES | [Al](F)(F)(F)(F)(F)[OH2].C1C[NH2+]CCC[NH2+]CC[NH2+]CCC[NH2+]1.O.[Al](F)(F)(F)(F)(F)[OH2].O |
| Title of publication | 1,4,8,11-Tetraazacyclodecane-1,4,8,11-tetraium bis(aquapentafluoroaluminate) dihydrate |
| Authors of publication | Goreshnik, E.; Leblanc, M.; Maisonneuve, V. |
| Journal of publication | Acta Crystallographica, Section E: Structure Reports Online |
| Year of publication | 2003 |
| Journal volume | 59 |
| Journal issue | 11 |
| Pages of publication | 1059 - 1061 |
| 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 |
| Space group number | 14 |
| Hermann-Mauguin space group symbol | P 1 21/n 1 |
| Hall space group symbol | -P 2yn |
| Duplicate of | 1100118 |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
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