Crystallography Open Database

Information card for entry 4335134

Preview

Coordinates	4335134.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	In Na1.4 O9.4 Te3.6
Calculated formula	In Na1.44 O9.404 Te3.5595
Title of publication	Na1.4InTe3.6O9.4: New Variant of a Hexagonal Tungsten Oxide (HTO)-Like Layered Framework Containing Both a Main-Group Cation, In3+, and a Lone-Pair Cation, Te4+
Authors of publication	Dong Woo Lee; Kang Min Ok
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	6236 - 6238
a	11.2026 ± 0.0005 Å
b	6.7162 ± 0.0003 Å
c	13.0527 ± 0.0006 Å
α	90°
β	107.457 ± 0.002°
γ	90°
Cell volume	936.84 ± 0.07 Å³
Cell temperature	298 ± 0.2 K
Ambient diffraction temperature	298 ± 0.2 K
Number of distinct elements	4
Space group number	13
Hermann-Mauguin space group symbol	P 1 2/c 1
Hall space group symbol	-P 2yc
Residual factor for all reflections	0.039
Residual factor for significantly intense reflections	0.0299
Weighted residual factors for significantly intense reflections	0.0675
Weighted residual factors for all reflections included in the refinement	0.0705
Goodness-of-fit parameter for all reflections included in the refinement	1.064
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
179454 (current)	2016-03-23	cif/4/33/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/33/51.	4335134.cif
101039	2014-02-10	cif/ Adding structures of 4335134 via cif-deposit CGI script.	4335134.cif