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Information card for entry 1559466
Preview
| Coordinates | 1559466.cif |
|---|---|
| Original paper (by DOI) | HTML |
| Common name | 1-methy1-8-(4-pyridyl-methylamino)-3,6,10,13,16,19- hexaazabicyclo[6.6.6]eicocanecobalt(III) tristrifluoromethane sulfonate monohydrate ([Co(H3CsarNHCH2py)](O,SCF3)3.H2O) |
|---|---|
| Formula | C24 H42 Co F9 N8 O10 S3 |
| Calculated formula | C24 Co F9 N8 O10 S3 |
| Title of publication | Cobalt(III) Cage Complexes Linked to 4-Pyridyl: Models for Protein Modification |
| Authors of publication | Gajhede, Michael; Hammershoi, Anders; Skov, Lars Kobberoe |
| Journal of publication | Acta Chemica Scandinavica |
| Year of publication | 1991 |
| Journal volume | 45 |
| Pages of publication | 474 - 481 |
| a | 9.035 ± 0.005 Å |
| b | 14.171 ± 0.005 Å |
| c | 15.17 ± 0.005 Å |
| α | 67.45 ± 0.03° |
| β | 88.43 ± 0.04° |
| γ | 85.02 ± 0.04° |
| Cell volume | 1787 ± 1.4 Å3 |
| Ambient diffraction temperature | 110 K |
| Number of distinct elements | 7 |
| Space group number | 2 |
| Hermann-Mauguin space group symbol | P -1 |
| Hall space group symbol | -P 1 |
| Residual factor for significantly intense reflections | 0.06 |
| Weighted residual factors for significantly intense reflections | 0.076 |
| 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 |
|---|---|---|---|
| 258778 (current) | 2020-11-06 | cif/ Adding structures of 1559466 via cif-deposit CGI script. |
1559466.cif |
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