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Information card for entry 2241508
Preview
| Coordinates | 2241508.cif |
|---|---|
| Structure factors | 2241508.hkl |
| Original IUCr paper | HTML |
| Chemical name | Trihydrogen bis{[1,1,1-tris(2-oxidoethylaminomethyl)ethane]cobalt(III)} trinitrate |
|---|---|
| Formula | C22 H51 Co2 N9 O15 |
| Calculated formula | C22 H51 Co2 N9 O15 |
| Title of publication | Crystal structure of trihydrogen bis{[1,1,1-tris(2-oxidoethylaminomethyl)ethane]cobalt(III)} trinitrate |
| Authors of publication | Sethi, Waqas; Johannesen, Heini V.; Morsing, Thorbjørn J.; Piligkos, Stergios; Weihe, Høgni |
| Journal of publication | Acta Crystallographica Section E |
| Year of publication | 2015 |
| Journal volume | 71 |
| Journal issue | 12 |
| Pages of publication | m275 - m276 |
| a | 8.543 ± 0.004 Å |
| b | 8.543 ± 0.004 Å |
| c | 39.11 ± 0.02 Å |
| α | 90° |
| β | 90° |
| γ | 120° |
| Cell volume | 2472 ± 2 Å3 |
| Cell temperature | 122 ± 2 K |
| Ambient diffraction temperature | 122 ± 2 K |
| Number of distinct elements | 5 |
| Space group number | 155 |
| Hermann-Mauguin space group symbol | R 3 2 |
| Hall space group symbol | R 3 2" |
| Residual factor for all reflections | 0.0225 |
| Residual factor for significantly intense reflections | 0.0205 |
| Weighted residual factors for significantly intense reflections | 0.0472 |
| Weighted residual factors for all reflections included in the refinement | 0.0475 |
| Goodness-of-fit parameter for all reflections included in the refinement | 0.807 |
| Diffraction radiation wavelength | 0.71073 Å |
| Diffraction radiation type | MoKα |
| Has coordinates | Yes |
| Has disorder | Yes |
| Has Fobs | Yes |
| Revision | Date | Message | Files |
|---|---|---|---|
| 181916 (current) | 2016-04-06 | hkl/2/24/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/24/15. |
2241508.cif 2241508.hkl |
| 174761 | 2016-01-22 | cif/ hkl/ Adding structures of 2241508 via cif-deposit CGI script. |
2241508.cif 2241508.hkl |
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Users of the data should acknowledge the original authors of the
structural data.