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CIF Information Card
Information card for 2014333
2014332 << 2014333 >> 2014334Preview
|
Coordinates |
2014333.cif |
Structure parameters
| Common name | Bis(azonia-12-crown-4) bis(4-aminobenzoate) trihydrate |
| Formula | - C30 H54 N4 O13 - |
| Calculated formula | - C30 H54 N4 O13 - |
| Title of publication | Hierarchy of hydrogen bonding in bis(1,4,7-trioxa-10-azoniacyclododecane) bis(4-aminobenzoate) trihydrate |
| Authors of publication | Basok, Stepan S.; Bocelli, Gabriele; Fonari, Marina S.; Ganin, Eduard V.; Simonov, Yurii A. |
| Journal of publication | Acta Crystallographica, Section C |
| Year of publication | 2006 |
| Journal volume | 62 |
| Pages of publication | o50 - o52 |
| a | 12.541 ± 0.003 Å |
| b | 9.5315 ± 0.0019 Å |
| c | 15.989 ± 0.003 Å |
| α | 90° |
| β | 110.91 ± 0.03° |
| γ | 90° |
| Cell volume | 1785.4 ± 0.6 Å3 |
| Cell temperature | 293 ± 2 K |
| Ambient diffraction temperature | 293 ± 2 K |
| Number of distinct elements | 4 |
| Hermann-Mauguin symmetry space group | P 1 21 1 |
| Hall symmetry space group | P 2yb |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |