Information card for entry 2101807
| Formula |
C80 H112 N8 Ni |
| Calculated formula |
C80 H112 N8 Ni |
| Title of publication |
Two Crystal Structures Towards the Discotic Columnar Mesophase of (1,4,8,11,15,18,22,25-Octahexylphthalocyaninato)nickel |
| Authors of publication |
Helliwell, M.; Deacon, A.; Moon, K. J.; Powell, A. K.; Cook, M. J. |
| Journal of publication |
Acta Crystallographica Section B |
| Year of publication |
1997 |
| Journal volume |
53 |
| Journal issue |
2 |
| Pages of publication |
231 - 240 |
| a |
22.55 ± 0.02 Å |
| b |
37.14 ± 0.01 Å |
| c |
18.994 ± 0.007 Å |
| α |
90° |
| β |
114.6 ± 0.05° |
| γ |
90° |
| Cell volume |
14464 ± 16 Å3 |
| Cell temperature |
295.2 K |
| Ambient diffraction temperature |
295.2 K |
| Number of distinct elements |
4 |
| Hermann-Mauguin space group symbol |
C 1 2/c 1 |
| Hall space group symbol |
-C 2yc |
| Residual factor for significantly intense reflections |
0.165 |
| Weighted residual factors for significantly intense reflections |
0.1347 |
| Goodness-of-fit parameter for significantly intense reflections |
3.294 |
| Diffraction radiation wavelength |
1.5418 Å |
| Diffraction radiation type |
CuKα |
| Has coordinates |
Yes |
| Has disorder |
No |
| Has Fobs |
No |
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https://www.crystallography.net/2101807.html
