Crystallography Open Database

Information card for entry 7241988

7241987 << 7241988 >> 7241989

Preview

Coordinates	7241988.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C3 H6 Br Cu N6
Calculated formula	C3 H6 Br Cu N6
Title of publication	Efficient removal of Pb2+ and Cd2+ using a Cu(i)‒Br coordination polymer constructed with an amino-rich ligand
Authors of publication	Hou, Qin; Yang, Qingfeng; Miao, Chengxia; Duan, Junling; Zhang, Yuanhong; Ai, Shiyun
Journal of publication	CrystEngComm
Year of publication	2021
Journal volume	23
Journal issue	6
Pages of publication	1489 - 1496
a	3.849 ± 0.006 Å
b	9.074 ± 0.015 Å
c	10.642 ± 0.017 Å
α	81.17 ± 0.04°
β	79.73 ± 0.02°
γ	77.77 ± 0.02°
Cell volume	354.8 ± 1 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296.15 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0985
Residual factor for significantly intense reflections	0.0686
Weighted residual factors for significantly intense reflections	0.1737
Weighted residual factors for all reflections included in the refinement	0.1887
Goodness-of-fit parameter for all reflections included in the refinement	0.985
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
262579 (current)	2021-03-05	cif/ Updating files of 7241988 Original log message: Adding full bibliography for 7241988.cif.	7241988.cif
260217	2020-12-30	cif/ Adding structures of 7241988 via cif-deposit CGI script.	7241988.cif