Crystallography Open Database

Information card for entry 4102702

Preview

Coordinates	4102702.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Iron Telluride
Chemical name	Iron Telluride
Formula	Fe1.12 Te
Calculated formula	Fe1.119 Te
SMILES	[Te-2].[Fe+2]
Title of publication	Iodine as an Oxidant in the Topotactic Deintercalation of Interstitial Iron in Fe1+xTe
Authors of publication	Efrain E. Rodriguez; Peter Zavalij; Ping-Yen Hsieh; Mark A. Green
Journal of publication	Journal of the American Chemical Society
Year of publication	2010
Journal volume	132
Pages of publication	10006 - 10008
a	3.8197 ± 0.0001 Å
b	3.8197 ± 0.0001 Å
c	6.2587 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	91.315 ± 0.004 Å³
Cell temperature	250 ± 2 K
Ambient diffraction temperature	250 ± 2 K
Number of distinct elements	2
Space group number	129
Hermann-Mauguin space group symbol	P 4/n m m :2
Hall space group symbol	-P 4a 2a
Residual factor for all reflections	0.0092
Residual factor for significantly intense reflections	0.0092
Weighted residual factors for significantly intense reflections	0.0217
Weighted residual factors for all reflections included in the refinement	0.0217
Goodness-of-fit parameter for all reflections included in the refinement	1.001
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
178773 (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 4/10/27.	4102702.cif
120076	2014-07-11	Adding DOIs to range 4/10 structures.	4102702.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4102702.cif
25604	2011-09-12	../uploads/cif-deposit/cod/cif Adding structures of 4102702 via cif-deposit CGI script.	4102702.cif