Crystallography Open Database

Information card for entry 7232191

Preview

Coordinates	7232191.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C7 H5 Cu N3
Calculated formula	C7 H5 Cu N3
Title of publication	Copper cyanide polymers with controllable dimensions modulated by rigid and flexible bis-(imidazole) ligands: synthesis, crystal structure and fluorescence properties
Authors of publication	Xu, Hui; Zhou, Bo-Yu; Yu, Kai; Su, Zhan-Hua; Zhou, Bai-Bin; Su, Zhong-Min
Journal of publication	CrystEngComm
Year of publication	2019
Journal volume	21
Journal issue	8
Pages of publication	1242
a	11.089 ± 0.007 Å
b	8.79 ± 0.005 Å
c	15.236 ± 0.009 Å
α	90°
β	102.882 ± 0.011°
γ	90°
Cell volume	1447.7 ± 1.5 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0381
Residual factor for significantly intense reflections	0.0291
Weighted residual factors for significantly intense reflections	0.0761
Weighted residual factors for all reflections included in the refinement	0.0802
Goodness-of-fit parameter for all reflections included in the refinement	1.064
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
223524 (current)	2019-11-07	cif/ Updating files of 7232190, 7232191, 7232192, 7232193, 7232194 Original log message: Adding full bibliography for 7232190--7232194.cif.	7232191.cif
213242	2019-01-22	cif/ Adding structures of 7232190, 7232191, 7232192, 7232193, 7232194 via cif-deposit CGI script.	7232191.cif