Crystallography Open Database

Information card for entry 4516100

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Coordinates	4516100.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Cs2 Hg S8 Sb4
Calculated formula	Cs2 Hg S8 Sb4
Title of publication	Two Mercury Antimony Chalcogenides Cs<sub>2</sub>HgSb<sub>4</sub>S<sub>8</sub> and Cs<sub>2</sub>Hg<sub>2</sub>Sb<sub>2</sub>Se<sub>6</sub> with Cesium Cations as Counterions.
Authors of publication	Du, Cui-Xia; Qi, Fei-Yan; Chen, Juan; Baiyin, Menghe
Journal of publication	ACS omega
Year of publication	2018
Journal volume	3
Journal issue	11
Pages of publication	15168 - 15173
a	7.3196 ± 0.0019 Å
b	10.6224 ± 0.0006 Å
c	11.7739 ± 0.0014 Å
α	99.51 ± 0.02°
β	92.06 ± 0.02°
γ	92.1 ± 0.02°
Cell volume	901.4 ± 0.3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0857
Residual factor for significantly intense reflections	0.0622
Weighted residual factors for significantly intense reflections	0.1435
Weighted residual factors for all reflections included in the refinement	0.1533
Goodness-of-fit parameter for all reflections included in the refinement	1.144
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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