Crystallography Open Database

Information card for entry 7034476

Preview

Coordinates	7034476.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Ba5 In4 S7 Te4
Calculated formula	Ba5 In4 S7 Te4
Title of publication	Synthesis and characterization of a new mid-infrared transparent compound: acentric Ba5In4Te4S7.
Authors of publication	Tan, De-Ming; Lin, Chen-Sheng; Luo, Zhong-Zhen; Zhang, Hao; Zhang, Wei-Long; He, Zhang-Zhen; Cheng, Wen-Dan
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2015
Journal volume	44
Journal issue	16
Pages of publication	7673 - 7678
a	39.11 ± 0.003 Å
b	4.3763 ± 0.0003 Å
c	7.3452 ± 0.0006 Å
α	90°
β	90°
γ	90°
Cell volume	1257.18 ± 0.17 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	44
Hermann-Mauguin space group symbol	I m m 2
Hall space group symbol	I 2 -2
Residual factor for all reflections	0.019
Residual factor for significantly intense reflections	0.0182
Weighted residual factors for significantly intense reflections	0.0442
Weighted residual factors for all reflections included in the refinement	0.0445
Goodness-of-fit parameter for all reflections included in the refinement	1.096
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
180050 (current)	2016-03-25	cif/7/03/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/03/44.	7034476.cif
138638	2015-06-07	cif/ Updating files of 7034476 Original log message: Adding full bibliography for 7034476.cif.	7034476.cif
134171	2015-03-20	cif/ Adding structures of 7034476 via cif-deposit CGI script.	7034476.cif