Crystallography Open Database

Information card for entry 4334389

Preview

Coordinates	4334389.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Bi H O6 Se2
Calculated formula	Bi H O6 Se2
Title of publication	New Bismuth Selenium Oxides: Syntheses, Structures, and Characterizations of Centrosymmetric Bi2(SeO3)2(SeO4) and Bi2(TeO3)2(SeO4) and Noncentrosymmetric Bi(SeO3)(HSeO3)
Authors of publication	Eun Pyo Lee; Seung Yoon Song; Dong Woo Lee; Kang Min Ok
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	4097 - 4103
a	5.5407 ± 0.0004 Å
b	6.6746 ± 0.0004 Å
c	15.4756 ± 0.0012 Å
α	90°
β	90.003 ± 0.005°
γ	90°
Cell volume	572.32 ± 0.07 Å³
Cell temperature	173 ± 0.2 K
Ambient diffraction temperature	173 ± 0.2 K
Number of distinct elements	4
Space group number	9
Hermann-Mauguin space group symbol	C 1 c 1
Hall space group symbol	C -2yc
Residual factor for all reflections	0.0555
Residual factor for significantly intense reflections	0.0485
Weighted residual factors for significantly intense reflections	0.1206
Weighted residual factors for all reflections included in the refinement	0.1512
Goodness-of-fit parameter for all reflections included in the refinement	1.127
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
179446 (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 4/33/43.	4334389.cif
100207	2014-02-04	cif/ Adding structures of 4334389 via cif-deposit CGI script.	4334389.cif