Crystallography Open Database

Information card for entry 7130196

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Coordinates	7130196.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	F8 Fe3 Na12 O24 S6
Calculated formula	F8 Fe3 Na12 O24 S6
Title of publication	Perovskite-derived structure modulation in the iron sulfate family
Authors of publication	Lan, Yuanqi; Yan, Qi; Zhang, Xinyuan; Yao, Wenjiao; Wang, Chenchen; Lee, Chun-Sing; Lightfoot, Philip; Tang, Yongbing
Journal of publication	Chemical Communications
Year of publication	2022
a	9.4765 ± 0.0008 Å
b	9.5081 ± 0.0009 Å
c	9.6072 ± 0.0008 Å
α	113.231 ± 0.003°
β	105.646 ± 0.002°
γ	108.917 ± 0.002°
Cell volume	669.18 ± 0.11 Å³
Cell temperature	297 ± 2 K
Ambient diffraction temperature	297 ± 2 K
Number of distinct elements	5
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0356
Residual factor for significantly intense reflections	0.0275
Weighted residual factors for significantly intense reflections	0.0622
Weighted residual factors for all reflections included in the refinement	0.0669
Goodness-of-fit parameter for all reflections included in the refinement	1.017
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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