Crystallography Open Database

Information card for entry 4106600

Preview

Coordinates	4106600.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C70 H81 Eu2 N23 O19
Calculated formula	C70 H79 Eu2 N23 O19
Title of publication	Highly Efficient Separation of Actinides from Lanthanides by a Phenanthroline-Derived Bis-triazine Ligand
Authors of publication	Frank W. Lewis; Laurence M. Harwood; Michael J. Hudson; Michael G. B. Drew; Jean F. Desreux; Geoffrey Vidick; Nouri Bouslimani; Giuseppe Modolo; Andreas Wilden; Michal Sypula; Trong-Hung Vu; Jean-Pierre Simonin
Journal of publication	Journal of the American Chemical Society
Year of publication	2011
Journal volume	133
Pages of publication	13093 - 13102
a	13.5768 ± 0.0008 Å
b	15.342 ± 0.001 Å
c	20.5094 ± 0.0013 Å
α	106.114 ± 0.006°
β	100.566 ± 0.005°
γ	98.556 ± 0.005°
Cell volume	3943.4 ± 0.5 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.1399
Residual factor for significantly intense reflections	0.0595
Weighted residual factors for significantly intense reflections	0.1088
Weighted residual factors for all reflections included in the refinement	0.1225
Goodness-of-fit parameter for all reflections included in the refinement	0.83
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
178812 (current)	2016-03-21	cif/4/10/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/10/66.	4106600.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4106600.cif
53402	2012-04-19	cif/ Adding structures of 4106600 via cif-deposit CGI script.	4106600.cif