Crystallography Open Database

Information card for entry 8106149

Preview

Coordinates	8106149.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C22 H22 N4 O16 S4 Zn3
Calculated formula	C22 H22 N4 O16 S4 Zn3
Title of publication	Crystal structure of poly[bis(1-methyl-[4,4′-bipyridin]-1-ium-κN)-tetrakis(μ3-sulfato-κ3 O:O′:O′′)trizinc(II)], C22H22Zn3N4O16S4
Authors of publication	Fu, Hong-Ru; Wang, Kai-Lu; Zhao, Xiao-Xiao
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2018
Journal volume	233
Journal issue	3
Pages of publication	349 - 351
a	9.2909 ± 0.0002 Å
b	16.8888 ± 0.0004 Å
c	19.3547 ± 0.0006 Å
α	90°
β	98.924 ± 0.003°
γ	90°
Cell volume	3000.22 ± 0.14 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
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	0.046
Residual factor for significantly intense reflections	0.0401
Weighted residual factors for significantly intense reflections	0.0912
Weighted residual factors for all reflections included in the refinement	0.0942
Goodness-of-fit parameter for all reflections included in the refinement	1.039
Diffraction radiation probe	x-ray
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
279383 (current)	2022-11-18	cif/ Adding structures of 8106149 via cif-deposit CGI script.	8106149.cif