Information card for entry 2020878
Chemical name |
<i>cis</i>-Dichloridobis(1,2,5-thiadiazolo[3,4-<i>f</i>][1,10]phenanthroline-κ^2^<i>N</i>^1^,<i>N</i>^10^)copper(II) |
Formula |
C24 H12 Cl2 Cu N8 S2 |
Calculated formula |
C24 H12 Cl2 Cu N8 S2 |
SMILES |
[Cu]12(Cl)(Cl)([n]3cccc4c3c3[n]1cccc3c1nsnc41)[n]1cccc3c1c1[n]2cccc1c1nsnc31 |
Title of publication |
Synthesis, crystal structure and biological properties of a <i>cis</i>-dichloridobis(diimine)copper(II) complex |
Authors of publication |
Bhat, Satish S.; Revankar, Vidyanand K.; Kumbar, Vijay; Bhat, Kishore; Kawade, Vitthal A. |
Journal of publication |
Acta Crystallographica Section C |
Year of publication |
2018 |
Journal volume |
74 |
Journal issue |
2 |
a |
8.181 ± 0.004 Å |
b |
12.168 ± 0.005 Å |
c |
22.99 ± 0.01 Å |
α |
90° |
β |
92.197 ± 0.007° |
γ |
90° |
Cell volume |
2286.9 ± 1.8 Å3 |
Cell temperature |
298 ± 2 K |
Ambient diffraction temperature |
298.15 K |
Number of distinct elements |
6 |
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 |
0.0483 |
Residual factor for significantly intense reflections |
0.0426 |
Weighted residual factors for significantly intense reflections |
0.1116 |
Weighted residual factors for all reflections included in the refinement |
0.1162 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.036 |
Diffraction radiation wavelength |
0.71073 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/2020878.html