Crystallography Open Database

Information card for entry 2108004

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Structure parameters

Formula	C24 H17 F6 N3 O4 Zn
Calculated formula	C24 H17 F6 N3 O4 Zn
Title of publication	Cu^II^ and Zn^II^ β-diketonate coordination polymers based on pyrimidin-2-amine, pyrazine and 1,2-bis(4-pyridyl)ethane
Authors of publication	Perdih, Franc
Journal of publication	Acta Crystallographica Section B
Year of publication	2016
Journal volume	72
Journal issue	6
Pages of publication	828 - 835
a	11.5334 ± 0.0004 Å
b	9.2949 ± 0.0002 Å
c	13.0287 ± 0.0005 Å
α	90°
β	115.198 ± 0.005°
γ	90°
Cell volume	1263.79 ± 0.09 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	6
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/n 1
Hall space group symbol	-P 2yac
Residual factor for all reflections	0.0479
Residual factor for significantly intense reflections	0.0344
Weighted residual factors for significantly intense reflections	0.0812
Weighted residual factors for all reflections included in the refinement	0.0893
Goodness-of-fit parameter for all reflections included in the refinement	1.055
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	Yes

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