Information card for entry 8101002
Formula |
C11 H14 F6 N2 O5 S2 |
Calculated formula |
C11 H14 F6 N2 O5 S2 |
SMILES |
S(=O)(=O)(N1CC(=O)CN(S(=O)(=O)C(F)(F)F)[C@H]2[C@H]1CCCC2)C(F)(F)F |
Title of publication |
Crystal structure of (R,R)-N,N'-(2-oxo-1,3-propanediyl)-N,N'-bis (trifluoromethylsulfonyl)-1,2-cyclohexanediamine, C~11~H~14~F~6~N~2~O~5~S~2~ |
Authors of publication |
Yao, Qingwei; Zheng, Chong; Li, Shoujian |
Journal of publication |
Zeitschrift für Kristallographie - New Crystal Structures |
Year of publication |
2001 |
Journal volume |
216 |
Journal issue |
3 |
Pages of publication |
338 - 340 |
a |
6.3625 ± 0.0001 Å |
b |
16.8205 ± 0.0002 Å |
c |
15.819 ± 0.0002 Å |
α |
90° |
β |
92.44° |
γ |
90° |
Cell volume |
1691.43 ± 0.04 Å3 |
Cell temperature |
173 ± 2 K |
Ambient diffraction temperature |
173 ± 2 K |
Number of distinct elements |
6 |
Space group number |
4 |
Hermann-Mauguin space group symbol |
P 1 21 1 |
Hall space group symbol |
P 2yb |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
No |
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The link is:
https://www.crystallography.net/8101002.html