Crystallography Open Database

Information card for entry 7129253

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Coordinates	7129253.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Cu Fe O S
Calculated formula	Cu Fe O S
Title of publication	Visible-light photoelectric response in semiconducting quaternary oxysulfide FeOCuS with anti-PbO-type structure
Authors of publication	Du, Wei; zhang, ganghua; Chen, Ping; Tang, Pingying; Wang, Jing; Li, Dezeng; Hou, Jingshan; Fang, Yongzheng
Journal of publication	Chemical Communications
Year of publication	2021
a	3.8219 ± 0.0005 Å
b	3.8219 ± 0.0005 Å
c	8.645 ± 0.003 Å
α	90°
β	90°
γ	90°
Cell volume	126.28 ± 0.05 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	129
Hermann-Mauguin space group symbol	P 4/n m m :2
Hall space group symbol	-P 4a 2a
Residual factor for all reflections	0.0587
Residual factor for significantly intense reflections	0.0542
Weighted residual factors for significantly intense reflections	0.1296
Weighted residual factors for all reflections included in the refinement	0.1336
Goodness-of-fit parameter for all reflections included in the refinement	1.066
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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