Information card for entry 2012895
Chemical name |
Tetra-n-butylammonium bis(2-thioxo-1,3-dithiole-4,5-dithiolato)nickelate(III) |
Formula |
C22 H36 N Ni S10 |
Calculated formula |
C22 H36 N Ni S10 |
Title of publication |
Tetra-<i>n</i>-butylammonium bis(2-thioxo-1,3-dithiole-4,5-dithiolato-κ^2^<i>S</i>^4^,<i>S</i>^5^)nickelate(III) |
Authors of publication |
Liu, Guoqun; Xue, Gang; Yu, Wentao; Xu, Wen |
Journal of publication |
Acta Crystallographica Section C |
Year of publication |
2002 |
Journal volume |
58 |
Journal issue |
8 |
Pages of publication |
m436 - m438 |
a |
20.191 ± 0.002 Å |
b |
13.4041 ± 0.0014 Å |
c |
12.1408 ± 0.0014 Å |
α |
90° |
β |
105.554 ± 0.008° |
γ |
90° |
Cell volume |
3165.5 ± 0.6 Å3 |
Cell temperature |
293 ± 2 K |
Ambient diffraction temperature |
293 ± 2 K |
Number of distinct elements |
5 |
Space group number |
15 |
Hermann-Mauguin space group symbol |
C 1 2/c 1 |
Hall space group symbol |
-C 2yc |
Residual factor for all reflections |
0.095 |
Residual factor for significantly intense reflections |
0.059 |
Weighted residual factors for significantly intense reflections |
0.14 |
Weighted residual factors for all reflections included in the refinement |
0.157 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.12 |
Diffraction radiation wavelength |
0.71073 Å |
Diffraction radiation type |
MoKα |
Has coordinates |
Yes |
Has disorder |
Yes |
Has Fobs |
Yes |
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