Information card for entry 2232109
Chemical name |
4-(4-Chlorophenyl)-8-methyl-2-oxo-1,2,3,4,4a,5,6,7- octahydroquinoline-3-carbonitrile |
Formula |
C17 H17 Cl N2 O |
Calculated formula |
C17 H17 Cl N2 O |
Title of publication |
4-(4-Chlorophenyl)-8-methyl-2-oxo-1,2,3,4,4a,5,6,7-octahydroquinoline-3-carbonitrile |
Authors of publication |
Asiri, Abdullah M.; Al-Youbi, Abdulrahman O.; Faidallah, Hassan M.; Badahdah, Khadija O.; Ng, Seik Weng |
Journal of publication |
Acta Crystallographica Section E |
Year of publication |
2011 |
Journal volume |
67 |
Journal issue |
10 |
Pages of publication |
o2597 |
a |
11.0699 ± 0.0007 Å |
b |
7.6018 ± 0.0003 Å |
c |
18.2247 ± 0.0009 Å |
α |
90° |
β |
100.505 ± 0.006° |
γ |
90° |
Cell volume |
1507.92 ± 0.14 Å3 |
Cell temperature |
100 ± 2 K |
Ambient diffraction temperature |
100 ± 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 |
0.1226 |
Residual factor for significantly intense reflections |
0.0785 |
Weighted residual factors for significantly intense reflections |
0.2462 |
Weighted residual factors for all reflections included in the refinement |
0.2729 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.104 |
Diffraction radiation wavelength |
1.54184 Å |
Diffraction radiation type |
CuKα |
Has coordinates |
Yes |
Has disorder |
Yes |
Has Fobs |
Yes |
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https://www.crystallography.net/2232109.html