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Information card for entry 1559543
Preview
| Coordinates | 1559543.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | 1,3,7,9,13,15,19,21-octaazaquinquecyclo [19.3.1.1(3,7).1(9,13).1(15,19)]octacosane |
|---|---|
| Formula | C22 H44 Cl4 N8 |
| Calculated formula | C22 H44 Cl4 N8 |
| Title of publication | Conformation of 1,3,7,9,13,15,19,21-octaazaquinquecyclo [19.3.1.1(3,7).1(9,13).1(15,19)]octacosane |
| Authors of publication | Dale, Johannes; Romming, Christian; Sigvartsen, Turid |
| Journal of publication | Acta Chemica Scandinavica |
| Year of publication | 1991 |
| Journal volume | 45 |
| Pages of publication | 1071 - 1075 |
| a | 10.577 ± 0.002 Å |
| b | 17.419 ± 0.004 Å |
| c | 31.889 ± 0.009 Å |
| α | 90° |
| β | 90° |
| γ | 90° |
| Cell volume | 5875 ± 2 Å3 |
| Ambient diffraction temperature | 138 K |
| Number of distinct elements | 4 |
| Space group number | 70 |
| Hermann-Mauguin space group symbol | F d d d :2 |
| Hall space group symbol | -F 2uv 2vw |
| Residual factor for significantly intense reflections | 0.049 |
| Weighted residual factors for significantly intense reflections | 0.04 |
| Goodness-of-fit parameter for all reflections included in the refinement | 1.6 |
| Diffraction radiation probe | x-ray |
| Diffraction radiation wavelength | 0.71069 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | No |
| Has Fobs | No |
| Revision | Date | Message | Files |
|---|---|---|---|
| 259222 (current) | 2020-11-23 | cif/ Adding structures of 1559543 via cif-deposit CGI script. |
1559543.cif |
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Users of the data should acknowledge the original authors of the
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