Crystallography Open Database

Information card for entry 1547277

Preview

Coordinates	1547277.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Fe5.94 Mg1.06 O9
Calculated formula	Fe5.94 Mg1.064 O9
Title of publication	Discovery of Fe7O9: a new iron oxide with a complex monoclinic structure
Authors of publication	Ryosuke Sinmyo; Elena Bykova; Sergey V. Ovsyannikov; Catherine McCammon; Ilya Kupenko; Leyla Ismailova; Leonid Dubrovinsky
Journal of publication	Scientific Reports
Year of publication	2016
Journal volume	6
Pages of publication	32852
a	9.6901 ± 0.0012 Å
b	2.8943 ± 0.0005 Å
c	11.4397 ± 0.0014 Å
α	90°
β	102.045 ± 0.014°
γ	90°
Cell volume	313.77 ± 0.08 Å³
Ambient diffraction temperature	293 K
Number of distinct elements	3
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.0508
Residual factor for significantly intense reflections	0.0427
Weighted residual factors for significantly intense reflections	0.1178
Weighted residual factors for all reflections included in the refinement	0.1229
Goodness-of-fit parameter for all reflections included in the refinement	1.194
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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