Information card for entry 2217931
Chemical name |
4-Hydroxy-2,2,6,6-tetramethylpiperidinium perchlorate |
Formula |
C9 H20 Cl N O5 |
Calculated formula |
C9 H20 Cl N O5 |
SMILES |
OC1CC([NH2+]C(C1)(C)C)(C)C.Cl(=O)(=O)(=O)[O-] |
Title of publication |
4-Hydroxy-2,2,6,6-tetramethylpiperidinium perchlorate |
Authors of publication |
Cui, Ying; Zhang, Yun-Hui; Zhang, Peng-Wei |
Journal of publication |
Acta Crystallographica Section E |
Year of publication |
2008 |
Journal volume |
64 |
Journal issue |
4 |
Pages of publication |
o654 |
a |
7.5712 ± 0.0015 Å |
b |
13.927 ± 0.003 Å |
c |
12.007 ± 0.002 Å |
α |
90° |
β |
100.71 ± 0.03° |
γ |
90° |
Cell volume |
1244 ± 0.4 Å3 |
Cell temperature |
113 ± 2 K |
Ambient diffraction temperature |
113 ± 2 K |
Number of distinct elements |
5 |
Space group number |
14 |
Hermann-Mauguin space group symbol |
P 1 21/n 1 |
Hall space group symbol |
-P 2yn |
Residual factor for all reflections |
0.0546 |
Residual factor for significantly intense reflections |
0.0451 |
Weighted residual factors for significantly intense reflections |
0.1172 |
Weighted residual factors for all reflections included in the refinement |
0.1269 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.098 |
Diffraction radiation wavelength |
0.71073 Å |
Diffraction radiation type |
MoKα |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
Yes |
For the version history of this entry, please navigate to main COD server.
The link is:
https://www.crystallography.net/2217931.html