Crystallography Open Database

Information card for entry 7232190

Preview

Coordinates	7232190.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C56 H42 Cu2 N14
Calculated formula	C56 H42 Cu2 N14
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	15.071 ± 0.003 Å
b	17.319 ± 0.004 Å
c	18.468 ± 0.004 Å
α	90°
β	96.99 ± 0.03°
γ	90°
Cell volume	4784.6 ± 1.8 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0872
Residual factor for significantly intense reflections	0.0458
Weighted residual factors for significantly intense reflections	0.1051
Weighted residual factors for all reflections included in the refinement	0.1265
Goodness-of-fit parameter for all reflections included in the refinement	1.015
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.	7232190.cif
213242	2019-01-22	cif/ Adding structures of 7232190, 7232191, 7232192, 7232193, 7232194 via cif-deposit CGI script.	7232190.cif