Crystallography Open Database

Information card for entry 4518520

Preview

Coordinates	4518520.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	none
Formula	C12 H27.75 N3.25 O S7 Sn3
Calculated formula	C10.5 H20.625 N2.625 O0.375 S7 Sn3
Title of publication	Layered Thiostannates with Distinct Arrangements of Mixed Cations for the Selective Capture of Cs<sup>+</sup>, Sr<sup>2+</sup>, and Eu<sup>3+</sup> Ions.
Authors of publication	Li, Wei-An; Li, Jian-Rong; Zhang, Bo; Sun, Hai-Yan; Jin, Jian-Ce; Huang, Xiao-Ying; Feng, Mei-Ling
Journal of publication	ACS applied materials & interfaces
Year of publication	2021
Journal volume	13
Journal issue	8
Pages of publication	10191 - 10201
a	26.2298 ± 0.0007 Å
b	26.2298 ± 0.0007 Å
c	17.6575 ± 0.0007 Å
α	90°
β	90°
γ	120°
Cell volume	10520.8 ± 0.6 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	6
Space group number	176
Hermann-Mauguin space group symbol	P 63/m
Hall space group symbol	-P 6c
Residual factor for all reflections	0.0595
Residual factor for significantly intense reflections	0.0429
Weighted residual factors for significantly intense reflections	0.1047
Weighted residual factors for all reflections included in the refinement	0.1164
Goodness-of-fit parameter for all reflections included in the refinement	1.101
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
262405 (current)	2021-03-03	cif/ Adding structures of 4518520 via cif-deposit CGI script.	4518520.cif