Crystallography Open Database

Information card for entry 7016049

Preview

Coordinates	7016049.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C47 H117 Ge9 Li Mo O6 Si12
Calculated formula	C47 H117 Ge9 Li Mo O6 Si12
Title of publication	[Si(SiMe(3))(3)](3)Ge(9)M(CO)(3)(-) (M = Cr, Mo, W): Coordination Chemistry with metalloid Clusters.
Authors of publication	Henke, Florian; Schenk, Christian; Schnepf, Andreas
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2011
Journal volume	40
Journal issue	25
Pages of publication	6704 - 6710
a	15.7684 ± 0.0008 Å
b	16.7824 ± 0.001 Å
c	32.886 ± 0.002 Å
α	90°
β	90.823 ± 0.008°
γ	90°
Cell volume	8701.8 ± 0.9 Å³
Cell temperature	199 ± 2 K
Ambient diffraction temperature	199 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0784
Residual factor for significantly intense reflections	0.0371
Weighted residual factors for significantly intense reflections	0.074
Weighted residual factors for all reflections included in the refinement	0.0839
Goodness-of-fit parameter for all reflections included in the refinement	0.866
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
288468 (current)	2023-12-21	Changed the disorder assembly of atomic site 'Si20' from an empty string to inapplicable ('.') in entry 7016049.	7016049.cif
179864	2016-03-25	cif/7/01/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/01/60.	7016049.cif
120112	2014-07-12	Adding DOIs to range 7 structures.	7016049.cif
35909	2012-02-26	cif/7/: reorganising range 7 into a prefix-directory tree.	7016049.cif
23615	2011-08-09	../uploads/cif-deposit/cod/cif Adding structures of 7016048, 7016049, 7016050, 7016051 via cif-deposit CGI script.	7016049.cif