Crystallography Open Database

Information card for entry 1551894

Preview

Coordinates	1551894.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	F Fe H4 O8 P2
Calculated formula	F Fe H4 O8 P2
Title of publication	Synthesis, crystal structure and possible proton conduction of Fe(H2PO4)2F
Authors of publication	Ma, Zihan; Lander, Laura; Nishimura, Shin-ichi; Fukakusa, Chihoko; Yamada, Teppei; Okubo, Masashi; Yamada, Atsuo
Journal of publication	Solid State Ionics
Year of publication	2019
Journal volume	338
Pages of publication	134
a	9.0187 ± 0.0001 Å
b	9.0187 ± 0.0001 Å
c	7.8058 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	634.9 ± 0.019 Å³
Cell temperature	295 K
Ambient diffraction temperature	295 K
Number of distinct elements	5
Space group number	140
Hermann-Mauguin space group symbol	I 4/m c m
Hall space group symbol	-I 4 2c
Residual factor for all reflections	0.023
Residual factor for significantly intense reflections	0.023
Weighted residual factors for significantly intense reflections	0.0696
Weighted residual factors for all reflections included in the refinement	0.0696
Goodness-of-fit parameter for all reflections included in the refinement	1.296
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

For the version history of this entry, please navigate to main COD server.
The link is: https://www.crystallography.net/1551894.html