Crystallography Open Database

Information card for entry 1562726

Preview

Coordinates	1562726.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	As4 Ba3 Cd2
Calculated formula	As4 Ba3 Cd2
Title of publication	Syntheses, crystal structure and physical properties of new Zintl phases Ba3T2As4 (T=Zn, Cd)
Authors of publication	Wang, Jian; Xia, Sheng-Qing; Tao, Xu-Tang
Journal of publication	Journal of Solid State Chemistry
Year of publication	2013
Journal volume	198
Pages of publication	6 - 9
a	17.089 ± 0.003 Å
b	4.6076 ± 0.0007 Å
c	7.3039 ± 0.0011 Å
α	90°
β	112.312 ± 0.001°
γ	90°
Cell volume	532.05 ± 0.15 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	3
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	0.0323
Residual factor for significantly intense reflections	0.0239
Weighted residual factors for significantly intense reflections	0.0425
Weighted residual factors for all reflections included in the refinement	0.0453
Goodness-of-fit parameter for all reflections included in the refinement	1.01
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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