Crystallography Open Database

Information card for entry 2011425

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Structure parameters

Formula	C26 H40 Cl6 N12 Si2
Calculated formula	C26 H40 Cl6 N12 Si2
SMILES	C([Si](Cl)(Cl)([n]1cn(C)cc1)([n]1cn(C)cc1)[n]1cn(C)cc1)C[Si](Cl)(Cl)([n]1cn(C)cc1)([n]1cn(C)cc1)[n]1cn(C)cc1.[Cl-].[Cl-]
Title of publication	The addition-reaction product of 1,1,1,4,4,4-hexachloro-1,4-disilabutane with <i>N</i>-methylimidazole
Authors of publication	Hensen, Karl; Spangenberg, Björn; Bolte, Michael
Journal of publication	Acta Crystallographica Section C
Year of publication	2000
Journal volume	56
Journal issue	10
Pages of publication	1245 - 1246
a	13.8976 ± 0.0001 Å
b	7.5553 ± 0.0001 Å
c	17.3704 ± 0.0002 Å
α	90°
β	97.947 ± 0.001°
γ	90°
Cell volume	1806.39 ± 0.03 Å³
Cell temperature	133 K
Ambient diffraction temperature	133 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	0.0637
Residual factor for significantly intense reflections	0.041
Weighted residual factors for all reflections	0.0847
Weighted residual factors for significantly intense reflections	0.0774
Weighted residual factors for all reflections included in the refinement	0.0847
Goodness-of-fit parameter for all reflections	1.078
Goodness-of-fit parameter for all reflections included in the refinement	1.078
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

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