Information card for entry 4033826
| Formula |
C17 H22 N2 O4 S2 |
| Calculated formula |
C17 H22 N2 O4 S2 |
| Title of publication |
Synthesis, Characterization, and Copper(II) Chelates of 1,11-Dithia-4,8-diazacyclotetradecane. |
| Authors of publication |
Taschner, Ian S.; Walker, Tia L.; DeHaan, Hunter S.; Schrage, Briana R.; Ziegler, Christopher J.; Taschner, Michael J. |
| Journal of publication |
The Journal of organic chemistry |
| Year of publication |
2019 |
| Journal volume |
84 |
| Journal issue |
17 |
| Pages of publication |
11091 - 11102 |
| a |
12.1657 ± 0.0006 Å |
| b |
17.8449 ± 0.0009 Å |
| c |
8.3153 ± 0.0004 Å |
| α |
90° |
| β |
90° |
| γ |
90° |
| Cell volume |
1805.22 ± 0.15 Å3 |
| Cell temperature |
100 ± 2 K |
| Ambient diffraction temperature |
100 ± 2 K |
| Number of distinct elements |
5 |
| Space group number |
41 |
| Hermann-Mauguin space group symbol |
A e a 2 |
| Hall space group symbol |
A 2 -2ab |
| Residual factor for all reflections |
0.0223 |
| Residual factor for significantly intense reflections |
0.0217 |
| Weighted residual factors for significantly intense reflections |
0.0594 |
| Weighted residual factors for all reflections included in the refinement |
0.06 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.012 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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https://www.crystallography.net/4033826.html
