Crystallography Open Database

Information card for entry 4518687

Preview

Coordinates	4518687.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C16 H36 Cu I2 N
Calculated formula	C16 H36 Cu I2 N
Title of publication	Efficient Dual-Band White-Light Emission with High Color Rendering from Zero-Dimensional Organic Copper Iodide.
Authors of publication	Lian, Linyuan; Zhang, Peng; Liang, Guijie; Wang, Song; Wang, Xi; Wang, Ya; Zhang, Xiuwen; Gao, Jianbo; Zhang, Daoli; Gao, Liang; Song, Haisheng; Chen, Rong; Lan, Xinzheng; Liang, Wenxi; Niu, Guangda; Tang, Jiang; Zhang, Jianbing
Journal of publication	ACS applied materials & interfaces
Year of publication	2021
Journal volume	13
Journal issue	19
Pages of publication	22749 - 22756
a	9.0685 ± 0.0002 Å
b	21.2193 ± 0.0001 Å
c	14.4387 ± 0.0005 Å
α	90°
β	125.301 ± 0.002°
γ	90°
Cell volume	2267.53 ± 0.11 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
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	0.0449
Residual factor for significantly intense reflections	0.0431
Weighted residual factors for significantly intense reflections	0.1223
Weighted residual factors for all reflections included in the refinement	0.1238
Goodness-of-fit parameter for all reflections included in the refinement	1.044
Diffraction radiation wavelength	1.54178 Å
Diffraction radiation type	CuKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
265744 (current)	2021-06-04	cif/ Updating files of 4518687 Original log message: Adding full bibliography for 4518687.cif.	4518687.cif
264838	2021-05-05	cif/ Adding structures of 4518687 via cif-deposit CGI script.	4518687.cif