Information card for entry 2009317
Chemical name |
Piperidinium 6-amino-3-methyl-5-nitrosopyrimidine-2,4(1H,3H)-dione |
Formula |
C10 H17 N5 O3 |
Calculated formula |
C10 H17 N5 O3 |
Title of publication |
Piperidinium 6-amino-3-methyl-5-nitroso-2,4-dioxo-1,2,3,4-tetrahydropyrimidin-1-ide |
Authors of publication |
Low, John Nicolson; Cobo, Justo; Melguizo, Manuel; Nogueras, Manuel; Sanchez, Adolfo |
Journal of publication |
Acta Crystallographica Section C |
Year of publication |
1999 |
Journal volume |
55 |
Journal issue |
12 |
Pages of publication |
IUC9900153 |
a |
10.055 ± 0.002 Å |
b |
10.405 ± 0.002 Å |
c |
12.138 ± 0.002 Å |
α |
100.89 ± 0.03° |
β |
98.99 ± 0.03° |
γ |
96.72 ± 0.03° |
Cell volume |
1217.6 ± 0.4 Å3 |
Cell temperature |
150 ± 0.1 K |
Ambient diffraction temperature |
150 ± 0.1 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 |
0.103 |
Residual factor for significantly intense reflections |
0.051 |
Weighted residual factors for all reflections included in the refinement |
0.135 |
Goodness-of-fit parameter for all reflections included in the refinement |
0.988 |
Diffraction radiation wavelength |
0.71073 Å |
Diffraction radiation type |
MoKα |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
Yes |
For the version history of this entry, please navigate to main COD server.
The link is:
https://www.crystallography.net/2009317.html