Crystallography Open Database

Information card for entry 4119282

4119281 << 4119282 >> 4119283

Preview

Coordinates	4119282.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Ba16 Cs8 Ga39.7 Sn96.3
Calculated formula	Ba16 Cs8 Ga39.616 Sn96.384
Title of publication	Tin Clathrates with the Type II Structure
Authors of publication	Marion C. Schäfer; Svilen Bobev
Journal of publication	Journal of the American Chemical Society
Year of publication	2013
Journal volume	135
Pages of publication	1696 - 1699
a	17.0347 ± 0.0006 Å
b	17.0347 ± 0.0006 Å
c	17.0347 ± 0.0006 Å
α	90°
β	90°
γ	90°
Cell volume	4943.1 ± 0.3 Å³
Cell temperature	250 ± 2 K
Ambient diffraction temperature	250 ± 2 K
Number of distinct elements	4
Space group number	227
Hermann-Mauguin space group symbol	F d -3 m :2
Hall space group symbol	-F 4vw 2vw 3
Residual factor for all reflections	0.0189
Residual factor for significantly intense reflections	0.0149
Weighted residual factors for significantly intense reflections	0.0346
Weighted residual factors for all reflections included in the refinement	0.0357
Goodness-of-fit parameter for all reflections included in the refinement	1.117
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
178963 (current)	2016-03-22	cif/4/11/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/11/92.	4119282.cif
103418	2014-03-04	cif/ Adding structures of 4119282 via cif-deposit CGI script.	4119282.cif