Crystallography Open Database

Information card for entry 7116056

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Structure parameters

Formula	C14 H34 Ge N2 S2 Si
Calculated formula	C14 H34 Ge N2 S2 Si
SMILES	[Ge]1(SCC)(SCC)N([Si](N1C(C)(C)C)(C)C)C(C)(C)C
Title of publication	Germane vs. digermane formation
Authors of publication	P. Steiniger; G. Bendt; D. Blaser; C. Wolper; S. Schulz
Journal of publication	Chem.Commun.
Year of publication	2014
Journal volume	50
Pages of publication	15461
a	11.7422 ± 0.0004 Å
b	12.1799 ± 0.0004 Å
c	14.9598 ± 0.0005 Å
α	90°
β	105.185 ± 0.001°
γ	90°
Cell volume	2064.83 ± 0.12 Å³
Cell temperature	100 ± 1 K
Ambient diffraction temperature	100 ± 1 K
Number of distinct elements	6
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	0.0216
Residual factor for significantly intense reflections	0.0175
Weighted residual factors for significantly intense reflections	0.0461
Weighted residual factors for all reflections included in the refinement	0.0486
Goodness-of-fit parameter for all reflections included in the refinement	1.077
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
301857 (current)	2025-08-22	Add cross-references to PubChem compounds in COD range 7/11/ Each referenced PubChem compound corresponds to the full crystal structure.	7116056.cif
180274	2016-03-26	cif/7/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/11/60.	7116056.cif
128844	2014-12-19	cif/ Adding structures of 7116051, 7116052, 7116053, 7116054, 7116055, 7116056, 7116057, 7116058 via cif-deposit CGI script.	7116056.cif