Crystallography Open Database

Information card for entry 4518817

Preview

Coordinates	4518817.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H44 Br4 N2 Pb0.87 Sn0.14
Calculated formula	C20 H44 Br4 N2 Pb0.864 Sn0.136
Title of publication	Efficiency-Tunable Single-Component White-Light Emission Realized in Hybrid Halides Through Metal Co-Occupation
Authors of publication	Fan, Liubing; Liu, Kunjie; Zeng, Qindan; Li, Mingyang; Cai, Hao; Zhou, Jun; He, Shihui; Zhao, Jing; Liu, Quanlin
Journal of publication	ACS Applied Materials & Interfaces
Year of publication	2021
Journal volume	13
Journal issue	25
Pages of publication	29835 - 29842
a	20.401 Å
b	8.446 Å
c	18.581 Å
α	90°
β	122.18°
γ	90°
Cell volume	2709.8 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0548
Residual factor for significantly intense reflections	0.0522
Weighted residual factors for significantly intense reflections	0.1318
Weighted residual factors for all reflections included in the refinement	0.1349
Goodness-of-fit parameter for all reflections included in the refinement	1.05
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
266952 (current)	2021-07-04	cif/ Updating files of 4518817 Original log message: Adding full bibliography for 4518817.cif.	4518817.cif
266494	2021-06-17	cif/ Adding structures of 4518817 via cif-deposit CGI script.	4518817.cif