Information card for entry 2232924
Chemical name |
2-[2-(2-Hydroxyethoxy)phenyl]-4,4,5,5-tetramethyl-2-imidazoline-1-oxyl 3-oxide |
Formula |
C15 H21 N2 O4 |
Calculated formula |
C15 H21 N2 O4 |
SMILES |
C1(C(C)(C)N(=C(c2ccccc2OCCO)[N]1=O)=O)(C)C |
Title of publication |
2-[2-(2-Hydroxyethoxy)phenyl]-4,4,5,5-tetramethyl-2-imidazoline-1-oxyl 3-oxide |
Authors of publication |
Jing, Lin-Lin; Ma, Hui-Ping; He, Lei; Fan, Peng-Cheng; Jia, Zheng-Ping |
Journal of publication |
Acta Crystallographica Section E |
Year of publication |
2011 |
Journal volume |
67 |
Journal issue |
12 |
Pages of publication |
o3503 |
a |
14.458 ± 0.007 Å |
b |
10.187 ± 0.005 Å |
c |
10.67 ± 0.005 Å |
α |
90° |
β |
90° |
γ |
90° |
Cell volume |
1571.5 ± 1.3 Å3 |
Cell temperature |
296 ± 2 K |
Ambient diffraction temperature |
296 ± 2 K |
Number of distinct elements |
4 |
Space group number |
29 |
Hermann-Mauguin space group symbol |
P c a 21 |
Hall space group symbol |
P 2c -2ac |
Residual factor for all reflections |
0.0572 |
Residual factor for significantly intense reflections |
0.0422 |
Weighted residual factors for significantly intense reflections |
0.0976 |
Weighted residual factors for all reflections included in the refinement |
0.1068 |
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 |
No |
Has Fobs |
Yes |
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https://www.crystallography.net/2232924.html