Crystallography Open Database

Information card for entry 4124139

Preview

Coordinates	4124139.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C10 H8 Cu I N2
Calculated formula	C10 H8 Cu I N2
Title of publication	A Family of Highly Efficient CuI-Based Lighting Phosphors Prepared by a Systematic, Bottom-up Synthetic Approach.
Authors of publication	Liu, Wei; Fang, Yang; Wei, George Z.; Teat, Simon J.; Xiong, Kecai; Hu, Zhichao; Lustig, William P.; Li, Jing
Journal of publication	Journal of the American Chemical Society
Year of publication	2015
Journal volume	137
Journal issue	29
Pages of publication	9400 - 9408
a	9.4898 ± 0.0013 Å
b	9.737 ± 0.0018 Å
c	12.2051 ± 0.0018 Å
α	90°
β	111.784 ± 0.002°
γ	90°
Cell volume	1047.2 ± 0.3 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0445
Residual factor for significantly intense reflections	0.0332
Weighted residual factors for significantly intense reflections	0.0636
Weighted residual factors for all reflections included in the refinement	0.0675
Goodness-of-fit parameter for all reflections included in the refinement	1.004
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
152847 (current)	2015-08-05	cif/ Updating files of 4124139, 4124140, 4124141, 4124142, 4124143, 4124144, 4124145, 4124146 Original log message: Adding full bibliography for 4124139--4124146.cif.	4124139.cif
152133	2015-07-17	cif/ Adding structures of 4124139 via cif-deposit CGI script.	4124139.cif