Crystallography Open Database

Information card for entry 1561714

Preview

Coordinates	1561714.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Fe H4 O6 S
Calculated formula	Fe H4 O6 S
Title of publication	A new member of ferrous sulfates, FeSO4·2H2O with PtS topology showing spin-canted long-range antiferromagnetic ordering
Authors of publication	Zhao, Long; Liu, Wei; Cao, Lixin; Su, Ge; Gao, Rongjie; Yang, Hongzhan
Journal of publication	Journal of Solid State Chemistry
Year of publication	2015
Journal volume	231
Pages of publication	58 - 63
a	6.316 Å
b	7.755 Å
c	8.988 Å
α	90°
β	90°
γ	90°
Cell volume	440.237 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	56
Hermann-Mauguin space group symbol	P c c n
Hall space group symbol	-P 2ab 2ac
Residual factor for all reflections	0.0369
Residual factor for significantly intense reflections	0.0359
Weighted residual factors for significantly intense reflections	0.1277
Weighted residual factors for all reflections included in the refinement	0.129
Goodness-of-fit parameter for all reflections included in the refinement	1.046
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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