Crystallography Open Database

Information card for entry 4336666

Preview

Coordinates	4336666.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Cs3 Ga7 O36 Se12
Calculated formula	Cs3.03 Ga7 O36 Se12
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	12.7106 ± 0.001 Å
b	12.7106 ± 0.001 Å
c	12.7106 ± 0.001 Å
α	90°
β	90°
γ	90°
Cell volume	2053.5 ± 0.3 Å³
Cell temperature	298 ± 0.2 K
Ambient diffraction temperature	298 ± 0.2 K
Number of distinct elements	4
Space group number	223
Hermann-Mauguin space group symbol	P m -3 n
Hall space group symbol	-P 4n 2 3
Residual factor for all reflections	0.0235
Residual factor for significantly intense reflections	0.0161
Weighted residual factors for significantly intense reflections	0.0301
Weighted residual factors for all reflections included in the refinement	0.0311
Goodness-of-fit parameter for all reflections included in the refinement	1
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.	4336666.cif
102673	2014-02-21	cif/ Adding structures of 4336666 via cif-deposit CGI script.	4336666.cif