Information card for entry 2239889
Chemical name |
(<i>N</i>^1^-Benzyl-<i>N</i>^1^,<i>N</i>^2^,<i>N</i>^2^-trimethylethane-1,2-diamine-κ^2^<i>N</i>,<i>N</i>')dichloridomercury(II) |
Formula |
C12 H20 Cl2 Hg N2 |
Calculated formula |
C12 H20 Cl2 Hg N2 |
SMILES |
[Hg]1(Cl)(Cl)[N](Cc2ccccc2)(CC[N]1(C)C)C |
Title of publication |
Crystal structure of (N1-benzyl-N1,N2,N2-trimethylethane-1,2-diamine-κ2N,N′)dichloridomercury(II) |
Authors of publication |
Manjare, Sudesh T.; Singh, Harkesh B.; Butcher, Ray J. |
Journal of publication |
Acta Crystallographica Section E Structure Reports Online |
Year of publication |
2014 |
Journal volume |
70 |
Journal issue |
9 |
Pages of publication |
118 |
a |
9.0839 ± 0.0003 Å |
b |
15.5367 ± 0.0006 Å |
c |
11.3161 ± 0.0005 Å |
α |
90° |
β |
104.324 ± 0.004° |
γ |
90° |
Cell volume |
1547.43 ± 0.11 Å3 |
Cell temperature |
200 ± 2 K |
Ambient diffraction temperature |
200 ± 2 K |
Number of distinct elements |
5 |
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 |
0.0906 |
Residual factor for significantly intense reflections |
0.0439 |
Weighted residual factors for significantly intense reflections |
0.0632 |
Weighted residual factors for all reflections included in the refinement |
0.0737 |
Goodness-of-fit parameter for all reflections included in the refinement |
0.962 |
Diffraction radiation wavelength |
0.71073 Å |
Diffraction radiation type |
MoKα |
Has coordinates |
Yes |
Has disorder |
No |
Has Fobs |
Yes |
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https://www.crystallography.net/2239889.html