Crystallography Open Database

Information card for entry 1564447

Preview

Coordinates	1564447.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H14 Cl6 Mn N4 O6
Calculated formula	C24 H14 Cl6 Mn N4 O6
Title of publication	The first 3, 5, 6-trichloropyridine-2-oxyacetate bridged manganese coordination polymer with features of π⋯π stacking and halogen⋯halogen interactions: Synthesis, crystal analysis and magnetic properties
Authors of publication	Li, Jun-Xia; Du, Zhong-Xiang; Pan, Qiu-Yue; Zhang, Lu-Lu; Liu, Duo-Li
Journal of publication	Inorganica Chimica Acta
Year of publication	2020
Journal volume	509
Pages of publication	119677
a	7.2516 ± 0.0004 Å
b	10.5428 ± 0.0009 Å
c	18.818 ± 0.0016 Å
α	77.275 ± 0.007°
β	83.739 ± 0.006°
γ	85.56 ± 0.006°
Cell volume	1392.85 ± 0.19 Å³
Cell temperature	289 ± 2 K
Ambient diffraction temperature	289.2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0944
Residual factor for significantly intense reflections	0.0678
Weighted residual factors for significantly intense reflections	0.1737
Weighted residual factors for all reflections included in the refinement	0.1855
Goodness-of-fit parameter for all reflections included in the refinement	1.075
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
268293 (current)	2021-08-30	cif/ Adding structures of 1564447 via cif-deposit CGI script.	1564447.cif