Crystallography Open Database

Information card for entry 4123674

Preview

Coordinates	4123674.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Se48 Sn24
Calculated formula	Se48 Sn24
Title of publication	Mimicking high-silica zeolites: highly stable germanium- and tin-rich zeolite-type chalcogenides.
Authors of publication	Lin, Qipu; Bu, Xianhui; Mao, Chengyu; Zhao, Xiang; Sasan, Koroush; Feng, Pingyun
Journal of publication	Journal of the American Chemical Society
Year of publication	2015
Journal volume	137
Journal issue	19
Pages of publication	6184 - 6187
a	22.4297 ± 0.0008 Å
b	22.4297 ± 0.0008 Å
c	22.4297 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	11284.2 ± 0.7 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	2
Space group number	217
Hermann-Mauguin space group symbol	I -4 3 m
Hall space group symbol	I -4 2 3
Residual factor for all reflections	0.114
Residual factor for significantly intense reflections	0.061
Weighted residual factors for significantly intense reflections	0.167
Weighted residual factors for all reflections included in the refinement	0.1968
Goodness-of-fit parameter for all reflections included in the refinement	1.07
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
176428 (current)	2016-02-13	Replaced deprecated COD CIF data names with their more modern alternatives. The _cod_cif_authors_sg_Hall and _cod_cif_authors_sg_H-M data items were renamed to _cod_original_sg_symbol_Hall and _cod_cif_authors_sg_H-M respectively.	4123674.cif
138248	2015-06-05	cif/ Updating files of 4123670, 4123671, 4123672, 4123673, 4123674, 4123675 Original log message: Adding full bibliography for 4123670--4123675.cif.	4123674.cif
136797	2015-05-18	cif/ Adding structures of 4123670, 4123671, 4123672, 4123673, 4123674, 4123675 via cif-deposit CGI script.	4123674.cif