Crystallography Open Database

Information card for entry 8105320

Preview

Coordinates	8105320.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C28 H26 Cl6 N4 Ni O8
Calculated formula	C28 H26 Cl6 N4 Ni O8
Title of publication	The crystal structure of catena-poly[(μ2-4,4′-dipyridine-κ2 N,N′)-bis(3,5,6-trichloropyridine-2-oxyacetato-κO)-bis(ethanol-κO)nickel(II)], C28H26Cl6N4NiO8
Authors of publication	Li, Jun-Xia; Du, Zhong-Xiang
Journal of publication	Zeitschrift für Kristallographie - New Crystal Structures
Year of publication	2020
Journal volume	235
Journal issue	4
Pages of publication	887 - 890
a	15.7577 ± 0.001 Å
b	12.6174 ± 0.0007 Å
c	16.7333 ± 0.001 Å
α	90°
β	99.609 ± 0.006°
γ	90°
Cell volume	3280.3 ± 0.3 Å³
Cell temperature	291 ± 2 K
Ambient diffraction temperature	291.2 ± 0.3 K
Number of distinct elements	6
Space group number	15
Hermann-Mauguin space group symbol	I 1 2/a 1
Hall space group symbol	-I 2ya
Residual factor for all reflections	0.1129
Residual factor for significantly intense reflections	0.0674
Weighted residual factors for significantly intense reflections	0.1312
Weighted residual factors for all reflections included in the refinement	0.1665
Goodness-of-fit parameter for all reflections included in the refinement	1.03
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
275576 (current)	2022-05-20	cif/ Adding structures of 8105320 via cif-deposit CGI script.	8105320.cif