Crystallography Open Database

Information card for entry 7128629

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Coordinates	7128629.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Ag5 Cl2 P S4
Calculated formula	Ag5 Cl2 P S4
Title of publication	From thiophosphate to chalcohalide: mixed-anion AgS<sub>x</sub>Cl<sub>y</sub> ligands concurrently enhancing nonlinear optical effects and laser-damage threshold.
Authors of publication	Gao, Lihua; Chu, Yu; Wu, Xiaowen; Zhang, Bingbing; Wu, Kui
Journal of publication	Chemical communications (Cambridge, England)
Year of publication	2021
Journal volume	57
Journal issue	66
Pages of publication	8218 - 8221
a	7.44 ± 0.03 Å
b	11.17 ± 0.04 Å
c	6.3 ± 0.02 Å
α	90°
β	90°
γ	90°
Cell volume	524 ± 3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	38
Hermann-Mauguin space group symbol	A m m 2
Hall space group symbol	A 2 -2
Residual factor for all reflections	0.0623
Residual factor for significantly intense reflections	0.0513
Weighted residual factors for significantly intense reflections	0.1515
Weighted residual factors for all reflections included in the refinement	0.1697
Goodness-of-fit parameter for all reflections included in the refinement	1.179
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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