Information card for entry 2243065
| Chemical name |
Tetramethylammonium 1,1,7,7-tetracyanohepta-2,4,6-trienide |
| Formula |
C15 H17 N5 |
| Calculated formula |
C15 H17 N5 |
| Title of publication |
Crystal structure of tetramethylammonium 1,1,7,7-tetracyanohepta-2,4,6-trienide |
| Authors of publication |
Bogdanov, Georgii; Tillotson, John P.; Bustos, Jenna; Fonari, Marina; Timofeeva, Tatiana V. |
| Journal of publication |
Acta Crystallographica Section E |
| Year of publication |
2019 |
| Journal volume |
75 |
| Journal issue |
9 |
| Pages of publication |
1344 - 1347 |
| a |
10.6043 ± 0.0005 Å |
| b |
9.4168 ± 0.0004 Å |
| c |
16.4423 ± 0.0007 Å |
| α |
90° |
| β |
107.886 ± 0.0017° |
| γ |
90° |
| Cell volume |
1562.55 ± 0.12 Å3 |
| Cell temperature |
150 ± 2 K |
| Ambient diffraction temperature |
150.15 K |
| Number of distinct elements |
3 |
| Space group number |
14 |
| Hermann-Mauguin space group symbol |
P 1 21/n 1 |
| Hall space group symbol |
-P 2yn |
| Residual factor for all reflections |
0.1271 |
| Residual factor for significantly intense reflections |
0.0666 |
| Weighted residual factors for significantly intense reflections |
0.1804 |
| Weighted residual factors for all reflections included in the refinement |
0.2214 |
| Goodness-of-fit parameter for all reflections included in the refinement |
1.025 |
| Diffraction radiation wavelength |
0.71073 Å |
| Diffraction radiation type |
MoKα |
| Has coordinates |
Yes |
| Has disorder |
Yes |
| Has Fobs |
Yes |
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