Crystallography Open Database

Information card for entry 7232248

Preview

Coordinates	7232248.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C6 H24 Fe N6 Se8 Sn3
Calculated formula	C6 H24 Fe N6 Se8 Sn3
Title of publication	Alcohol-solvothermal syntheses, crystal structures and photocatalytic properties of tin selenides with polyselenide ligands
Authors of publication	Han, Jingyu; Zhang, Limei; Li, Shufen; Zheng, Wei; Jia, Dingxian; Yuan, Yaxian
Journal of publication	CrystEngComm
Year of publication	2019
Journal volume	21
Journal issue	10
Pages of publication	1642
a	11.95 ± 0.002 Å
b	14.083 ± 0.003 Å
c	17.995 ± 0.006 Å
α	90°
β	120.25 ± 0.02°
γ	90°
Cell volume	2616 ± 1.2 Å³
Cell temperature	223 ± 2 K
Ambient diffraction temperature	223 ± 2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0618
Residual factor for significantly intense reflections	0.048
Weighted residual factors for significantly intense reflections	0.0862
Weighted residual factors for all reflections included in the refinement	0.1094
Goodness-of-fit parameter for all reflections included in the refinement	1.111
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
223487 (current)	2019-11-07	cif/ Updating files of 7232246, 7232247, 7232248, 7232249, 7232250, 7232251, 7232252, 7232253 Original log message: Adding full bibliography for 7232246--7232253.cif.	7232248.cif
213374	2019-01-30	cif/ Adding structures of 7232246, 7232247, 7232248, 7232249, 7232250, 7232251, 7232252, 7232253 via cif-deposit CGI script.	7232248.cif