Crystallography Open Database

Information card for entry 4330116

Preview

Coordinates	4330116.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	O7.5 S Sb3
Calculated formula	O7.5 S Sb3
SMILES	[Sb+3].[Sb+3].[Sb+3].[Sb+3].[Sb+3].[Sb+3].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].[O-2].S(=O)(=O)([O-])[O-].S(=O)(=O)([O-])[O-]
Title of publication	A Cationic Antimonite Chain Templated by Sulfate: [Sb6O74+][(SO42-)2]
Authors of publication	Honghan Fei; Cari S. Han; Scott R. J. Oliver
Journal of publication	Inorganic Chemistry
Year of publication	2012
Journal volume	51
Pages of publication	8655 - 8657
a	12.0329 ± 0.0006 Å
b	18.9371 ± 0.001 Å
c	5.8595 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	1335.19 ± 0.12 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	3
Space group number	37
Hermann-Mauguin space group symbol	C c c 2
Hall space group symbol	C 2 -2c
Residual factor for all reflections	0.0116
Residual factor for significantly intense reflections	0.0115
Weighted residual factors for significantly intense reflections	0.0278
Weighted residual factors for all reflections included in the refinement	0.0278
Goodness-of-fit parameter for all reflections included in the refinement	1.097
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
176467 (current)	2016-02-16	cif/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in range 4.	4330116.cif
79364	2013-04-04	cif/ Adding structures of 4330116 via cif-deposit CGI script.	4330116.cif