Crystallography Open Database

Information card for entry 4317234

Preview

Coordinates	4317234.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	H12 In2 K6 O6 Te6
Calculated formula	In2 K6 O6 Te6
SMILES	[K+].[K+].O.[K+].O.O.[In]1([Te])([Te][In]([Te])([Te]1)[Te])[Te].[K+].[K+].O.[K+].O.O
Title of publication	Aqueous Telluridoindate Chemistry: Water-Soluble Salts of Monomeric, Dimeric, and Trimeric In/Te Anions [InTe4]5-, [In2Te6]6-, and [In3Te10]11-
Authors of publication	Johanna Heine; Stefanie Dehnen
Journal of publication	Inorganic Chemistry
Year of publication	2010
Journal volume	49
Pages of publication	11216 - 11222
a	8.993 ± 0.003 Å
b	14.372 ± 0.004 Å
c	11.602 ± 0.004 Å
α	90°
β	118.62 ± 0.03°
γ	90°
Cell volume	1316.3 ± 0.8 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 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	0.0289
Residual factor for significantly intense reflections	0.0236
Weighted residual factors for significantly intense reflections	0.0533
Weighted residual factors for all reflections included in the refinement	0.0545
Goodness-of-fit parameter for all reflections included in the refinement	1.023
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
179252 (current)	2016-03-23	cif/4/31/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/31/72.	4317234.cif
91935	2013-12-29	cod/ (saulius@koala.ibt.lt) Adding DOIs that could be assigned unambiguously to the rest of COD CIFs.	4317234.cif
34330	2012-02-24	cif/4/ Reorganising CIF range 4 into a prefix tree.	4317234.cif
10746	2011-02-12	../uploads/cif-deposit/cod/cif Adding structures of 4317234 via cif-deposit CGI script.	4317234.cif