Crystallography Open Database

Information card for entry 7037153

Preview

Coordinates	7037153.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Ga Ge3 Na Se8
Calculated formula	Ga Ge3 Na Se8
Title of publication	Syntheses, crystal structures and physical properties of three new chalcogenides: NaGaGe3Se8, K3Ga3Ge7S20, and K3Ga3Ge7Se20.
Authors of publication	Li, Xiaoshuang; Li, Chao; Gong, Pifu; Lin, Zheshuai; Yao, Jiyong; Wu, Yicheng
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	45
Journal issue	2
Pages of publication	532 - 538
a	7.2329 ± 0.0014 Å
b	11.889 ± 0.002 Å
c	17.55 ± 0.004 Å
α	90°
β	101.75 ± 0.03°
γ	90°
Cell volume	1477.5 ± 0.5 Å³
Cell temperature	153.15 K
Ambient diffraction temperature	153.15 K
Number of distinct elements	4
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	0.0881
Residual factor for significantly intense reflections	0.0664
Weighted residual factors for significantly intense reflections	0.1044
Weighted residual factors for all reflections included in the refinement	0.1145
Goodness-of-fit parameter for all reflections included in the refinement	0.897
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
176428 (current)	2016-02-13	Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively.	7037153.cif
175993	2016-02-05	cif/ Updating files of 7037153, 7037154, 7037155 Original log message: Adding full bibliography for 7037153--7037155.cif.	7037153.cif
170240	2015-11-12	cif/ Adding structures of 7037153, 7037154, 7037155 via cif-deposit CGI script.	7037153.cif