Crystallography Open Database

Information card for entry 4336668

Preview

Coordinates	4336668.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Ga3 H6 K O14 Se2
Calculated formula	Ga3 H6 K O14 Se2
Title of publication	From an Open Framework to a Layered and a Hexagonal Tungsten Oxide Structure: Controlled Transformation Reactions of an Extended Solid-State Material, Cs3Ga7(SeO3)12 to Ga(OH)(SeO3) and KGa3(SeO4)2(OH)6
Authors of publication	Hyun Sun Ahn; Dong Woo Lee; Kang Min Ok
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	12726 - 12730
a	7.2476 ± 0.001 Å
b	7.2476 ± 0.001 Å
c	17.746 ± 0.002 Å
α	90°
β	90°
γ	120°
Cell volume	807.27 ± 0.18 Å³
Cell temperature	298 ± 0.2 K
Ambient diffraction temperature	298 ± 0.2 K
Number of distinct elements	5
Space group number	166
Hermann-Mauguin space group symbol	R -3 m :H
Hall space group symbol	-R 3 2"
Residual factor for all reflections	0.0245
Residual factor for significantly intense reflections	0.0223
Weighted residual factors for significantly intense reflections	0.059
Weighted residual factors for all reflections included in the refinement	0.0597
Goodness-of-fit parameter for all reflections included in the refinement	1.184
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
179469 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/66.	4336668.cif
102675	2014-02-21	cif/ Adding structures of 4336668 via cif-deposit CGI script.	4336668.cif