Information card for entry 7703128
| Chemical name |
(2,2',2'',2'''-(1,4,8,11-Tetraazacyclotetradecane-1,4,8,11-tetrayl)tetraacetamide)-cobalt(ii) diperchlorate monohydrate |
| Formula |
C18 H38 Cl2 Co N8 O13 |
| Calculated formula |
C18 H38 Cl2 Co N8 O13 |
| Title of publication |
Isomeric Co(ii) paraCEST agents as pH responsive MRI probes. |
| Authors of publication |
Bond, Christopher J.; Cineus, Roy; Nazarenko, Alexander Y.; Spernyak, Joseph A.; Morrow, Janet R. |
| Journal of publication |
Dalton transactions (Cambridge, England : 2003) |
| Year of publication |
2020 |
| Journal volume |
49 |
| Journal issue |
2 |
| Pages of publication |
279 - 284 |
| a |
8.8541 ± 0.0006 Å |
| b |
9.9859 ± 0.0008 Å |
| c |
17.8607 ± 0.0014 Å |
| α |
92.863 ± 0.002° |
| β |
103.261 ± 0.002° |
| γ |
111.451 ± 0.002° |
| Cell volume |
1414.9 ± 0.19 Å3 |
| Cell temperature |
173 ± 2 K |
| Ambient diffraction temperature |
173 K |
| Number of distinct elements |
6 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.0369 |
| Residual factor for significantly intense reflections |
0.0308 |
| Weighted residual factors for significantly intense reflections |
0.0781 |
| Weighted residual factors for all reflections included in the refinement |
0.0816 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.048 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
No |
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The link is:
https://www.crystallography.net/7703128.html
