Crystallography Open Database

Information card for entry 7031302

Preview

Coordinates	7031302.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C25 H17 F24 N Nd O9.4
Calculated formula	C25 H17 F24 N Nd O9.395
Title of publication	Homogeneous liquid-liquid extraction of neodymium(iii) by choline hexafluoroacetylacetonate in the ionic liquid choline bis(trifluoromethylsulfonyl)imide.
Authors of publication	Onghena, Bieke; Jacobs, Jeroen; Van Meervelt, Luc; Binnemans, Koen
Journal of publication	Dalton transactions (Cambridge, England : 2003)
Year of publication	2014
Journal volume	43
Journal issue	30
Pages of publication	11566 - 11578
a	11.03826 ± 0.00019 Å
b	18.5663 ± 0.0005 Å
c	17.8663 ± 0.0003 Å
α	90°
β	92.0479 ± 0.0017°
γ	90°
Cell volume	3659.17 ± 0.13 Å³
Cell temperature	100.01 ± 0.1 K
Ambient diffraction temperature	100.01 ± 0.1 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0622
Residual factor for significantly intense reflections	0.0481
Weighted residual factors for significantly intense reflections	0.116
Weighted residual factors for all reflections included in the refinement	0.129
Goodness-of-fit parameter for all reflections included in the refinement	1.051
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

Version history

Revision	Date	Message	Files
176453 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 7.	7031302.cif
121651	2014-08-08	cif/ Updating files of 7031302 Original log message: Adding full bibliography for 7031302.cif.	7031302.cif
116427	2014-06-11	cif/ Adding structures of 7031302 via cif-deposit CGI script.	7031302.cif