Crystallography Open Database

Information card for entry 4001458

Preview

Coordinates	4001458.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	Cadimum Antimony Selenobromide
Formula	Br2 Cd Sb2 Se3
Calculated formula	Br2 Cd Sb2 Se3
Title of publication	A New Series of Chalcohalide Semiconductors with Composite CdBr2/Sb2Se3Lattices: Synthesis and Characterization of CdSb2Se3Br2and Indium Derivatives InSb2S4X (X = Cl and Br) and InM2Se4Br (M = Sb and Bi)
Authors of publication	Wang, Lei; Hwu, Shiou-Jyh
Journal of publication	Chemistry of Materials
Year of publication	2007
Journal volume	19
Journal issue	25
Pages of publication	6212
a	20.998 ± 0.004 Å
b	4.026 ± 0.0008 Å
c	12.149 ± 0.002 Å
α	90°
β	119 ± 0.03°
γ	90°
Cell volume	898.3 ± 0.4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.059
Residual factor for significantly intense reflections	0.0566
Weighted residual factors for significantly intense reflections	0.133
Weighted residual factors for all reflections included in the refinement	0.1357
Goodness-of-fit parameter for all reflections included in the refinement	1.142
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.	4001458.cif
120073	2014-07-11	Adding DOIs to range 4/00 structures.	4001458.cif
45273	2012-03-20	../uploads/cif-deposit/cod/cif Adding structures of 4001458, 4001459, 4001460, 4001461, 4001462 via cif-deposit CGI script.	4001458.cif