Crystallography Open Database: Information card for 7000398

Structure parameters

Common name	(N,N'-bis(o-fluorophenyl)diaza-18-crown-6)diperchlorato barium(ii)
Chemical name	{N,N'-bis(o-fluorophenyl)diaza-18-crown-6}diperchlorato barium(II)
Formula	C24 H32 Ba Cl2 F2 N2 O12
Calculated formula	C24 H32 Ba Cl2 F2 N2 O12
Title of publication	Lariat ethers with fluoroaryl side-arms: a study of CF⋯metal cation interaction in the complexes of N-(o-fluoroaryl)azacrown ethers
Authors of publication	Sazonov, Petr K.; Minacheva, Lidiya Kh.; Churakov, Andrei V.; Sergienko, Vladimir S.; Artamkina, Galina A.; Oprunenko, Yuri F.; Beletskaya, Irina P.
Journal of publication	Dalton Transactions
Year of publication	2009
Journal issue	5
Pages of publication	843 - 850
a	8.178 ± 0.003 Å
b	12.054 ± 0.003 Å
c	15.072 ± 0.004 Å
α	90°
β	99.02 ± 0.03°
γ	90°
Cell volume	1467.4 ± 0.8 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	7
Hermann-Mauguin symmetry space group	P 1 21/n 1
Hall symmetry space group	-P 2yn
Residual factor for all reflections	0.2164
Residual factor for observed reflections	0.0442
Weighted residual factors for the observed reflections	0.0694
Weighted residual factors for all reflections included in the refinement	0.0992
Goodness-of-fit parameter for observed reflections	0.949
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Crystallography Open Database