Crystallography Open Database

Information card for entry 7126409

Preview

Coordinates	7126409.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 H28 Br12 Cu6 N4 Pb
Calculated formula	C12 H28 Br12 Cu6 N4 Pb
Title of publication	A three-dimensional cuprous lead bromide framework with highly efficient and stable thermochromic luminescence properties.
Authors of publication	Jing, Chang-Qing; Wu, Jia-Hang; Cao, Yao-Yao; Che, Hang-Xin; Zhao, Xian-Mei; Yue, Meng; Liao, Yuan-Yuan; Yue, Cheng-Yang; Lei, Xiao-Wu
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2020
Journal volume	56
Journal issue	44
Pages of publication	5925 - 5928
a	11.453 ± 0.0015 Å
b	11.453 ± 0.0015 Å
c	22.637 ± 0.003 Å
α	90°
β	90°
γ	120°
Cell volume	2571.5 ± 0.6 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.0305
Residual factor for significantly intense reflections	0.026
Weighted residual factors for significantly intense reflections	0.0616
Weighted residual factors for all reflections included in the refinement	0.063
Goodness-of-fit parameter for all reflections included in the refinement	1.101
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
252684 (current)	2020-06-05	cif/ Updating files of 7126409 Original log message: Adding full bibliography for 7126409.cif.	7126409.cif
250929	2020-04-19	cif/ Adding structures of 7126409 via cif-deposit CGI script.	7126409.cif