Crystallography Open Database

Information card for entry 4329124

Preview

Coordinates	4329124.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Mo2 O11 Se2 Sr
Calculated formula	Mo2 O11 Se2 Sr
Title of publication	Influence of the Cation Size on the Framework Structures and Space Group Centricities in AMo2O5(SeO3)2 (A = Sr, Pb, and Ba)
Authors of publication	Seung-Jin Oh; Dong Woo Lee; Kang Min Ok
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	5393 - 5399
a	7.8759 ± 0.0006 Å
b	8.1509 ± 0.0005 Å
c	8.8076 ± 0.0006 Å
α	82.943 ± 0.005°
β	65.326 ± 0.005°
γ	66.918 ± 0.005°
Cell volume	472.09 ± 0.06 Å³
Cell temperature	200 ± 0.2 K
Ambient diffraction temperature	200 ± 0.2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.08
Residual factor for significantly intense reflections	0.0522
Weighted residual factors for significantly intense reflections	0.1155
Weighted residual factors for all reflections included in the refinement	0.1262
Goodness-of-fit parameter for all reflections included in the refinement	1.005
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
179394 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/91.	4329124.cif
78164	2013-04-01	cif/ Adding structures of 4329124 via cif-deposit CGI script.	4329124.cif