Information card for entry 7219472
| Common name |
2-cyanopyrimidine |
| Chemical name |
2-cyanopyrimidine |
| Formula |
C5 H3 N3 |
| Calculated formula |
C5 H3 N3 |
| Title of publication |
Elucidating the elusive crystal structure of 2,4,6-tris(2-pyrimidyl)-1,3,5-triazine |
| Authors of publication |
Safin, Damir A.; Tumanov, Nikolay A.; Leitch, Alicea A.; Brusso, Jaclyn L.; Filinchuk, Yaroslav; Murugesu, Muralee |
| Journal of publication |
CrystEngComm |
| Year of publication |
2015 |
| Journal volume |
17 |
| Journal issue |
10 |
| Pages of publication |
2190 |
| a |
3.97105 ± 0.00006 Å |
| b |
8.1277 ± 0.00014 Å |
| c |
16.0709 ± 0.0003 Å |
| α |
90° |
| β |
90° |
| γ |
90° |
| Cell volume |
518.696 ± 0.015 Å3 |
| Cell temperature |
295 K |
| Ambient diffraction temperature |
295 K |
| Number of distinct elements |
3 |
| Space group number |
19 |
| Hermann-Mauguin space group symbol |
P 21 21 21 |
| Hall space group symbol |
P 2ac 2ab |
| Residual factor R(I) for significantly intense reflections |
11.1463 |
| Goodness-of-fit parameter for all reflections |
29.33 |
| Method of determination |
powder diffraction |
| Diffraction radiation wavelength |
0.68884 Å |
| Diffraction radiation type |
synchrotron |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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The link is:
https://www.crystallography.net/7219472.html
