Crystallography Open Database

Information card for entry 4301917

4301916 << 4301917 >> 4301918

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Coordinates	4301917.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Er K8 O80 Si2 W22
Calculated formula	Er0.8 K10.376 O68 Si1.6 W17.6
Title of publication	Mononuclear Lanthanide Single Molecule Magnets Based on the Polyoxometalates [Ln(W5O18)2]9- and [Ln(β2-SiW11O39)2]13- (LnIII= Tb, Dy, Ho, Er, Tm, and Yb)
Authors of publication	Murad A. AlDamen; Salvador Cardona-Serra; Juan M. Clemente-Juan; Eugenio Coronado; Alejandro Gaita-Ariño; Carlos Martí-Gastaldo; Fernando Luis; Oscar Montero
Journal of publication	Inorganic Chemistry
Year of publication	2009
Journal volume	48
Pages of publication	3467 - 3479
a	20.208 ± 0.0004 Å
b	20.535 ± 0.0002 Å
c	27.294 ± 0.0005 Å
α	90°
β	113.805 ± 0.0007°
γ	90°
Cell volume	10362.6 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1206
Residual factor for significantly intense reflections	0.0817
Weighted residual factors for significantly intense reflections	0.2084
Weighted residual factors for all reflections included in the refinement	0.2405
Goodness-of-fit parameter for all reflections included in the refinement	1.028
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
179057 (current)	2016-03-22	cif/4/30/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/30/19.	4301917.cif
120081	2014-07-12	Adding DOIs to range 4/30 structures.	4301917.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4301917.cif
1054	2010-03-28	cif/4/ Adding data extracted in Inorg-Chem-2009_01-10/ processing.	4301917.cif