Information card for entry 1559229
Chemical name |
Chlorido(4'-chloro-2,2':6',2''-terpyridine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'')(trifluoromethanesulfonato-κ<i>O</i>)zinc(II) acetonitrile monosolvate |
Formula |
C18 H13 Cl2 F3 N4 O3 S Zn |
Calculated formula |
C18 H13 Cl2 F3 N4 O3 S Zn |
SMILES |
[Zn]12(Cl)(OS(=O)(=O)C(F)(F)F)[n]3c(c4[n]1cccc4)cc(Cl)cc3c1[n]2cccc1.N#CC |
Title of publication |
Chlorido(4'-chloro-2,2':6',2''-terpyridine-κ^3^<i>N</i>,<i>N</i>',<i>N</i>'')(trifluoromethanesulfonato-κ<i>O</i>)zinc(II) acetonitrile monosolvate |
Authors of publication |
Adrian, Rafael A.; Arman, Hadi D. |
Journal of publication |
IUCrData |
Year of publication |
2020 |
Journal volume |
5 |
Journal issue |
9 |
a |
7.655 ± 0.0014 Å |
b |
15.329 ± 0.003 Å |
c |
18.486 ± 0.004 Å |
α |
90° |
β |
92.088 ± 0.007° |
γ |
90° |
Cell volume |
2167.8 ± 0.7 Å3 |
Cell temperature |
98 K |
Ambient diffraction temperature |
98 K |
Number of distinct elements |
8 |
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 |
0.0298 |
Residual factor for significantly intense reflections |
0.027 |
Weighted residual factors for significantly intense reflections |
0.0736 |
Weighted residual factors for all reflections included in the refinement |
0.0751 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.053 |
Diffraction radiation wavelength |
0.71075 Å |
Diffraction radiation type |
MoKα |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
Yes |
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The link is:
https://www.crystallography.net/1559229.html