Information card for entry 2210197
Chemical name |
3(5,10)-Anthracena-7(1,3)-benzena-1,5(1,3)-diimidazolacyclooctaphane-1,3-diium dihexafluorophosphate acetonitrile trisolvate |
Formula |
C36 H35 F12 N7 P2 |
Calculated formula |
C36 H35 F12 N7 P2 |
Title of publication |
3(5,10)-Anthracena-7(1,3)-benzena-1,5(1,3)-diimidazolacyclooctaphane-1,3-diium bis(hexafluorophosphate) acetonitrile trisolvate |
Authors of publication |
Da-Bin Qin; Lin-Hai Jin; Shao-Jin Gu; Huan-Xia zhang |
Journal of publication |
Acta Crystallographica Section E |
Year of publication |
2006 |
Journal volume |
62 |
Journal issue |
9 |
Pages of publication |
o4176 - o4177 |
a |
8.643 ± 0.002 Å |
b |
22.391 ± 0.006 Å |
c |
20.983 ± 0.005 Å |
α |
90° |
β |
98.506 ± 0.005° |
γ |
90° |
Cell volume |
4016.1 ± 1.7 Å3 |
Cell temperature |
294 ± 2 K |
Ambient diffraction temperature |
294 ± 2 K |
Number of distinct elements |
5 |
Space group number |
14 |
Hermann-Mauguin space group symbol |
P 1 21/c 1 |
Hall space group symbol |
-P 2ybc |
Residual factor for all reflections |
0.1421 |
Residual factor for significantly intense reflections |
0.0542 |
Weighted residual factors for significantly intense reflections |
0.1338 |
Weighted residual factors for all reflections included in the refinement |
0.1794 |
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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https://www.crystallography.net/2210197.html