Information card for entry 2220563
Common name |
N,N'-Di-(tert-butylsulfinyl)-1,2-di-tert-butylethane-1,2-diamine |
Chemical name |
1,2-di-tert-butylethane-1,2-diyl bis(tert-butanesulfinamide) |
Formula |
C18 H40 N2 O2 S2 |
Calculated formula |
C18 H40 N2 O2 S2 |
SMILES |
S(=O)(N[C@H](C(C)(C)C)[C@H](NS(=O)C(C)(C)C)C(C)(C)C)C(C)(C)C |
Title of publication |
1,2-Di-<i>tert</i>-butylethane-1,2-diyl bis(<i>tert</i>-butanesulfinamide) |
Authors of publication |
Sun, Xiaoxia; Hu, Yu; Fan, Congbin; Xiao, Weihong |
Journal of publication |
Acta Crystallographica Section E |
Year of publication |
2009 |
Journal volume |
65 |
Journal issue |
1 |
Pages of publication |
o172 |
a |
13.053 ± 0.002 Å |
b |
9.578 ± 0.001 Å |
c |
18.279 ± 0.002 Å |
α |
90° |
β |
92.069 ± 0.008° |
γ |
90° |
Cell volume |
2283.8 ± 0.5 Å3 |
Cell temperature |
287 ± 2 K |
Ambient diffraction temperature |
287 ± 2 K |
Number of distinct elements |
5 |
Space group number |
14 |
Hermann-Mauguin space group symbol |
P 1 21/c 1 |
Hall space group symbol |
-P 2ybc |
Residual factor for all reflections |
0.0546 |
Residual factor for significantly intense reflections |
0.036 |
Weighted residual factors for significantly intense reflections |
0.0916 |
Weighted residual factors for all reflections included in the refinement |
0.096 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.002 |
Diffraction radiation wavelength |
0.71073 Å |
Diffraction radiation type |
MoKα |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
Yes |
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The link is:
https://www.crystallography.net/2220563.html