Information card for entry 2235249
Chemical name |
{4,4',6,6'-Tetrabromo-2,2'-[2,2-dimethylpropane-1,3-diylbis(nitrilomethanylylidene)]diphenolato}nickel(II) |
Formula |
C19 H16 Br4 N2 Ni O2 |
Calculated formula |
C19 H16 Br4 N2 Ni O2 |
SMILES |
c12c(cc(cc2C=[N]2CC(C[N]3=Cc4c(c(cc(c4)Br)Br)O[Ni]23O1)(C)C)Br)Br |
Title of publication |
{4,4',6,6'-Tetrabromo-2,2'-[2,2-dimethylpropane-1,3-diylbis(nitrilomethanylylidene)]diphenolato}nickel(II) |
Authors of publication |
Kargar, Hadi; Kia, Reza; Tahir, Muhammad Nawaz |
Journal of publication |
Acta Crystallographica Section E |
Year of publication |
2012 |
Journal volume |
68 |
Journal issue |
6 |
Pages of publication |
m753 |
a |
16.1125 ± 0.0011 Å |
b |
15.4789 ± 0.0012 Å |
c |
8.4734 ± 0.0005 Å |
α |
90° |
β |
90° |
γ |
90° |
Cell volume |
2113.3 ± 0.3 Å3 |
Cell temperature |
296 ± 2 K |
Ambient diffraction temperature |
296 ± 2 K |
Number of distinct elements |
6 |
Space group number |
60 |
Hermann-Mauguin space group symbol |
P b c n |
Hall space group symbol |
-P 2n 2ab |
Residual factor for all reflections |
0.0544 |
Residual factor for significantly intense reflections |
0.0328 |
Weighted residual factors for significantly intense reflections |
0.0677 |
Weighted residual factors for all reflections included in the refinement |
0.0753 |
Goodness-of-fit parameter for all reflections included in the refinement |
1.05 |
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/2235249.html