Crystallography Open Database

Information card for entry 7214225

Preview

Coordinates	7214225.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Ba9 F10 In4 S10
Calculated formula	Ba9 F10 In4 S10
Title of publication	Ba18F18In8S21 and Ba9F10In4S10: new kind of mixed anion compounds with the novel low-dimensional structure
Authors of publication	Luo, Zhong-Zhen; Lin, Chen-Sheng; Zhang, Wei-Long; Zhang, Hao; He, Zhang-Zhen; Cheng, Wen-Dan
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	13
Pages of publication	2788
a	12.5686 ± 0.0008 Å
b	19.2822 ± 0.0012 Å
c	12.5835 ± 0.0009 Å
α	90°
β	90°
γ	90°
Cell volume	3049.6 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	62
Hermann-Mauguin space group symbol	P n m a
Hall space group symbol	-P 2ac 2n
Residual factor for all reflections	0.0586
Residual factor for significantly intense reflections	0.0523
Weighted residual factors for significantly intense reflections	0.1418
Weighted residual factors for all reflections included in the refinement	0.1477
Goodness-of-fit parameter for all reflections included in the refinement	1.049
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
180473 (current)	2016-03-26	cif/7/21/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/21/42.	7214225.cif
108265	2014-03-30	cif/ Adding structures of 7214224, 7214225 via cif-deposit CGI script.	7214225.cif