Crystallography Open Database

Information card for entry 4350803

Preview

Coordinates	4350803.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C29 H22 Cl F3 N4 O6 S2 Zn
Calculated formula	C29 H22 Cl F3 N4 O6 S2 Zn
Title of publication	Crystal structures and biological activities of a symmetrical quinoline thioether ligand and its transition metal complexes
Authors of publication	Zou, Xun-Zhong; Zhang, Jing-An; Zhang, Li-Jie; Liu, Ya-Jie; Li, Ning; Li, Yu; Wei, Shi-Chao; Pan, Mei
Journal of publication	Inorganic Chemistry Communications
Year of publication	2015
Journal volume	54
Pages of publication	21 - 24
a	12.533 ± 0.0006 Å
b	15.3134 ± 0.0008 Å
c	15.5429 ± 0.0008 Å
α	90°
β	97.372 ± 0.001°
γ	90°
Cell volume	2958.4 ± 0.3 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	8
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0418
Residual factor for significantly intense reflections	0.0376
Weighted residual factors for significantly intense reflections	0.0971
Weighted residual factors for all reflections included in the refinement	0.1
Goodness-of-fit parameter for all reflections included in the refinement	1.033
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
272313 (current)	2022-01-28	cif/ Adding structures of 4350801, 4350802, 4350803, 4350804, 4350805 via cif-deposit CGI script.	4350803.cif