Crystallography Open Database

Information card for entry 4334388

Preview

Coordinates	4334388.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Bi2 O10 Se Te2
Calculated formula	Bi2 O10 Se Te2
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	8.0995 ± 0.0002 Å
b	7.4835 ± 0.0002 Å
c	14.8219 ± 0.0005 Å
α	90°
β	97.824 ± 0.003°
γ	90°
Cell volume	890.03 ± 0.04 Å³
Cell temperature	173 ± 0.2 K
Ambient diffraction temperature	173 ± 0.2 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	I 1 2/a 1
Hall space group symbol	-I 2ya
Residual factor for all reflections	0.0722
Residual factor for significantly intense reflections	0.047
Weighted residual factors for significantly intense reflections	0.1312
Weighted residual factors for all reflections included in the refinement	0.1383
Goodness-of-fit parameter for all reflections included in the refinement	1.083
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
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4334388.cif
100206	2014-02-04	cif/ Adding structures of 4334388 via cif-deposit CGI script.	4334388.cif