Crystallography Open Database

Information card for entry 4328404

Preview

Coordinates	4328404.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Nb3.63 Sc2 Sn5
Calculated formula	Nb3.6358 Sc2 Sn5
Title of publication	Syntheses and Structures of Sc2Nb4-xSn5, YNb6Sn6, and ErNb6Sn5: Exploratory Studies in Ternary Rare-Earth Niobium Stannides
Authors of publication	Cheng-Yang Yue; Xiao-Wu Lei
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	2461 - 2471
a	8.672 ± 0.003 Å
b	18.719 ± 0.006 Å
c	5.6645 ± 0.0016 Å
α	90°
β	90°
γ	90°
Cell volume	919.5 ± 0.5 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	3
Space group number	72
Hermann-Mauguin space group symbol	I b a m
Hall space group symbol	-I 2 2c
Residual factor for all reflections	0.0105
Residual factor for significantly intense reflections	0.0094
Weighted residual factors for significantly intense reflections	0.018
Weighted residual factors for all reflections included in the refinement	0.0187
Goodness-of-fit parameter for all reflections included in the refinement	1.171
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
179387 (current)	2016-03-23	cif/4/32/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/32/84.	4328404.cif
77370	2013-03-26	cif/ Adding structures of 4328404 via cif-deposit CGI script.	4328404.cif