Crystallography Open Database

Information card for entry 2239407

Preview

Coordinates	2239407.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	Tetracadmium diarsenide tribromide
Formula	As2 Br3 Cd4
Calculated formula	As2 Br3 Cd4
Title of publication	Cd~4~As~2~Br~3~
Authors of publication	Kars, Mohammed; Roisnel, Thierry; Dorcet, Vincent; Rebbah, Allaoua; Otero-Diáz, L. Carlos
Journal of publication	Acta Crystallographica Section E
Year of publication	2014
Journal volume	70
Journal issue	3
Pages of publication	i15
a	12.625 ± 0.004 Å
b	12.625 Å
c	12.625 Å
α	90°
β	90°
γ	90°
Cell volume	2012.3 ± 0.6 Å³
Cell temperature	150 ± 2 K
Ambient diffraction temperature	150 ± 2 K
Number of distinct elements	3
Space group number	205
Hermann-Mauguin space group symbol	P a -3
Hall space group symbol	-P 2ac 2ab 3
Residual factor for all reflections	0.0508
Residual factor for significantly intense reflections	0.0386
Weighted residual factors for significantly intense reflections	0.0883
Weighted residual factors for all reflections included in the refinement	0.0923
Goodness-of-fit parameter for all reflections included in the refinement	1.09
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
176798 (current)	2016-02-21	cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23.	2239407.cif
110690	2014-04-19	cif/ hkl/ Adding structures of 2239407 via cif-deposit CGI script.	2239407.cif