Information card for entry 2005949
| Chemical name |
dihexyl 2,6-dimethyl-4-(3-nitrophenyl)pyridine-3,5-dicarboxylate |
| Formula |
C27 H36 N2 O6 |
| Calculated formula |
C27 H35 N3 O8 |
| Title of publication |
3-Ethoxycarbonyl-5-methoxycarbonyl-2,6-dimethyl-4-(3-nitrophenyl)pyridinium Nitrate, Dineopentyl 2,6-Dimethyl-4-(3-nitrophenyl)pyridine-3,5-dicarboxylate and Dihexyl 2,6-Dimethyl-4-(3-nitrophenyl)pyridine-3,5-dicarboxylate |
| Authors of publication |
Rowan, K. R.; Holt, E. M. |
| Journal of publication |
Acta Crystallographica Section C |
| Year of publication |
1997 |
| Journal volume |
53 |
| Journal issue |
2 |
| Pages of publication |
257 - 261 |
| a |
8.089 ± 0.002 Å |
| b |
11.495 ± 0.002 Å |
| c |
15.707 ± 0.005 Å |
| α |
69.29 ± 0.02° |
| β |
88.12 ± 0.02° |
| γ |
87.03 ± 0.02° |
| Cell volume |
1364.1 ± 0.6 Å3 |
| Cell temperature |
298 K |
| Ambient diffraction temperature |
298 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 significantly intense reflections |
0.0583 |
| Weighted residual factors for significantly intense reflections |
0.1267 |
| Goodness-of-fit parameter for significantly intense reflections |
0.853 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
For the version history of this entry, please navigate to main COD server.
The link is:
https://www.crystallography.net/2005949.html
