Information card for entry 2233808
Chemical name |
2-(Adamantan-1-yl)-5-(4-nitrophenyl)-1,3,4-oxadiazole |
Formula |
C18 H19 N3 O3 |
Calculated formula |
C18 H19 N3 O3 |
Title of publication |
2-(Adamantan-1-yl)-5-(4-nitrophenyl)-1,3,4-oxadiazole |
Authors of publication |
El-Emam, Ali A.; Kadi, Adnan A.; El-Brollosy, Nasser R.; Ng, Seik Weng; Tiekink, Edward R. T. |
Journal of publication |
Acta Crystallographica Section E |
Year of publication |
2012 |
Journal volume |
68 |
Journal issue |
3 |
Pages of publication |
o795 |
a |
6.8502 ± 0.0006 Å |
b |
6.5705 ± 0.0007 Å |
c |
17.6761 ± 0.0015 Å |
α |
90° |
β |
98.432 ± 0.008° |
γ |
90° |
Cell volume |
786.99 ± 0.13 Å3 |
Cell temperature |
100 ± 2 K |
Ambient diffraction temperature |
100 ± 2 K |
Number of distinct elements |
4 |
Space group number |
11 |
Hermann-Mauguin space group symbol |
P 1 21/m 1 |
Hall space group symbol |
-P 2yb |
Residual factor for all reflections |
0.0675 |
Residual factor for significantly intense reflections |
0.0465 |
Weighted residual factors for significantly intense reflections |
0.1076 |
Weighted residual factors for all reflections included in the refinement |
0.123 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.047 |
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/2233808.html