Crystallography Open Database

Information card for entry 8106838

Preview

Coordinates	8106838.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	[Tri(3-(2-pyridyl)pyrazole)zinc(II)] Zinc(II) Tetrachloride
Formula	C24 H21 Cl4 N9 Zn2
Calculated formula	C24 H21 Cl4 N9 Zn2
Title of publication	Crystal structure of tris(3-(2-pyridyl)pyrazole)zinc(II)tetrachlorido zincate(II), C24H21Cl4N9Zn2
Authors of publication	Zhu, Guang-Zhou; Li, Chun-Ling; Wang, Ao-Lan; Wang, Shi-Yu; Zou, Dan-Ling; Zhang, Xiao-Jing; Yang, Feng-Lei
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2016
Journal volume	231
Journal issue	1
Pages of publication	241 - 242
a	13.331 ± 0.0013 Å
b	13.331 ± 0.0013 Å
c	58.07 ± 0.009 Å
α	90°
β	90°
γ	120°
Cell volume	8937.3 ± 1.9 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	167
Hermann-Mauguin space group symbol	R -3 c :H
Hall space group symbol	-R 3 2"c
Residual factor for all reflections	0.0725
Residual factor for significantly intense reflections	0.0408
Weighted residual factors for significantly intense reflections	0.1132
Weighted residual factors for all reflections included in the refinement	0.1491
Goodness-of-fit parameter for all reflections included in the refinement	1.006
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
281658 (current)	2023-03-06	cif/ Adding structures of 8106838 via cif-deposit CGI script.	8106838.cif