Crystallography Open Database

Information card for entry 7062180

Preview

Coordinates	7062180.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C8 H17 Cu I2 N2
Calculated formula	C8 H17 Cu I2 N2
Title of publication	Systematic regulation of ligands realizes the transition of luminescence color cuprous iodide inorganic–organic hybrid materials from blue to green light
Authors of publication	Shao, Juan-Juan; Ni, Jian-Ling; Chen, Wei-Min; Liu, Peng-Lai; Mensah, Abraham; Chen, Li-Zhuang; Wang, Fang-Ming
Journal of publication	New Journal of Chemistry
Year of publication	2023
Journal volume	47
Journal issue	5
Pages of publication	2556 - 2564
a	12.3656 ± 0.0003 Å
b	11.6981 ± 0.0003 Å
c	18.3655 ± 0.0005 Å
α	90°
β	90°
γ	90°
Cell volume	2656.64 ± 0.12 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	5
Space group number	61
Hermann-Mauguin space group symbol	P b c a
Hall space group symbol	-P 2ac 2ab
Residual factor for all reflections	0.0276
Residual factor for significantly intense reflections	0.0219
Weighted residual factors for significantly intense reflections	0.052
Weighted residual factors for all reflections included in the refinement	0.0546
Goodness-of-fit parameter for all reflections included in the refinement	1.056
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
281509 (current)	2023-03-04	cif/ Updating files of 7062180, 7062181, 7062182, 7062183 Original log message: Adding full bibliography for 7062180--7062183.cif.	7062180.cif
280053	2022-12-28	cif/ Adding structures of 7062180, 7062181, 7062182, 7062183 via cif-deposit CGI script.	7062180.cif