Crystallography Open Database

Information card for entry 4349725

Preview

Coordinates	4349725.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Ba9Sn3Te15
Formula	Ba9 Sn2.94 Te15
Calculated formula	Ba9 Sn2.928 Te14.978
Title of publication	Synthesis, crystal structures, and electronic properties of one dimensional Ba9Sn3(Te1−xSex)15 (x = 0‒1)
Authors of publication	Zhang, Jun; Su, Rui; Wang, Xiancheng; Li, Wenmin; Zhao, Jianfa; Deng, Zheng; Zhang, Sijia; Feng, Shaomin; Liu, Qingqing; Zhao, Huaizhou; Guan, Pengfei; Jin, Changqing
Journal of publication	Inorganic Chemistry Frontiers
Year of publication	2017
Journal volume	4
Journal issue	8
Pages of publication	1337
a	10.2403 ± 0.001 Å
b	10.2403 ± 0.001 Å
c	20.772 ± 0.0019 Å
α	90°
β	90°
γ	120°
Cell volume	1886.4 ± 0.3 Å³
Cell temperature	298 K
Ambient diffraction temperature	299.65 K
Number of distinct elements	3
Space group number	188
Hermann-Mauguin space group symbol	P -6 c 2
Hall space group symbol	P -6c 2
Residual factor for all reflections	0.0284
Residual factor for significantly intense reflections	0.0265
Weighted residual factors for significantly intense reflections	0.0558
Weighted residual factors for all reflections included in the refinement	0.0566
Goodness-of-fit parameter for all reflections included in the refinement	1.188
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
235768 (current)	2019-11-24	cif/ Adding structures of 4349725 via cif-deposit CGI script.	4349725.cif