Information card for entry 2234935
| Chemical name |
1-Isopropyl-4,7-dimethyl-2,8-dinitronaphthalene |
| Formula |
C15 H16 N2 O4 |
| Calculated formula |
C15 H16 N2 O4 |
| Title of publication |
1-Isopropyl-4,7-dimethyl-2,8-dinitronaphthalene |
| Authors of publication |
Chakkar, Mouna; Oughris, Najia; Benharref, Ahmed; Daran, Jean-Claude; Berraho, Moha |
| Journal of publication |
Acta Crystallographica Section E |
| Year of publication |
2012 |
| Journal volume |
68 |
| Journal issue |
6 |
| Pages of publication |
o1893 |
| a |
11.7784 ± 0.0007 Å |
| b |
11.9072 ± 0.0009 Å |
| c |
12.4494 ± 0.001 Å |
| α |
107.928 ± 0.007° |
| β |
112.834 ± 0.007° |
| γ |
104.536 ± 0.006° |
| Cell volume |
1387.7 ± 0.2 Å3 |
| Cell temperature |
180 ± 2 K |
| Ambient diffraction temperature |
180 ± 2 K |
| Number of distinct elements |
4 |
| Space group number |
2 |
| Hermann-Mauguin space group symbol |
P -1 |
| Hall space group symbol |
-P 1 |
| Residual factor for all reflections |
0.0662 |
| Residual factor for significantly intense reflections |
0.0562 |
| Weighted residual factors for significantly intense reflections |
0.1447 |
| Weighted residual factors for all reflections included in the refinement |
0.1521 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.077 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
Yes |
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https://www.crystallography.net/2234935.html
