Crystallography Open Database

Information card for entry 4002034

4002033 << 4002034 >> 4002035

Preview

Coordinates	4002034.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	H22 N4 O3 S6 Sn2
Calculated formula	H22 N4 O3 S6 Sn2
SMILES	[NH4+].[NH4+].O.O.[S-][Sn]1(S[Sn](S1)([S-])[S-])[S-].[NH4+].[NH4+].O
Title of publication	(NH4)4Sn2S6·3H2O: Crystal Structure, Thermal Decomposition, and Precursor for Textured Thin Film
Authors of publication	Nørby, Peter; Overgaard, Jacob; Christensen, Per S.; Richter, Bo; Song, Xin; Dong, Mingdong; Han, Anpan; Skibsted, Jørgen; Iversen, Bo B.; Johnsen, Simon
Journal of publication	Chemistry of Materials
Year of publication	2014
Journal volume	26
Journal issue	15
Pages of publication	4494
a	8.56294 ± 0.00008 Å
b	8.56294 ± 0.00008 Å
c	22.7703 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	1669.61 ± 0.03 Å³
Cell temperature	99.99 ± 0.1 K
Ambient diffraction temperature	99.97 ± 0.11 K
Number of distinct elements	5
Space group number	92
Hermann-Mauguin space group symbol	P 41 21 2
Hall space group symbol	P 4abw 2nw
Residual factor for all reflections	0.0185
Residual factor for significantly intense reflections	0.0162
Weighted residual factors for significantly intense reflections	0.0313
Weighted residual factors for all reflections included in the refinement	0.0322
Goodness-of-fit parameter for all reflections included in the refinement	1.077
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
178377 (current)	2016-03-21	cif/4/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/00.	4002034.cif
122876	2014-09-06	cif/ Updating files of 4002034 Original log message: Adding full bibliography for 4002034.cif.	4002034.cif
120654	2014-07-23	cif/ Adding structures of 4002034 via cif-deposit CGI script.	4002034.cif