Crystallography Open Database

Information card for entry 1000351

Preview

Coordinates	1000351.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	Iron phosphate fluoride hydroxide hydrate (1.2/1/0.5/0.2/0.4)
Formula	F0.45 Fe1.21 H0.92 O4.55 P
Calculated formula	F0.45 Fe1.212 H0.23 O4.55 P
Title of publication	Crystal structure and magnetic study of a new iron(III) phosphate, Fe~1.21~PO~4~X (X=F, OH, H~2~O), isostructural with 3MgSO~4~ . Mg(OH)~2~ . H~2~O
Authors of publication	Loiseau, Th; Lacorre, Ph; Calage, Y; Greneche, J M; Ferey, G
Journal of publication	Journal of Solid State Chemistry
Year of publication	1993
Journal volume	105
Pages of publication	417 - 427
a	5.184 ± 0.001 Å
b	5.184 ± 0.001 Å
c	13.04 ± 0.005 Å
α	90°
β	90°
γ	90°
Cell volume	350.4 Å³
Number of distinct elements	5
Space group number	141
Hermann-Mauguin space group symbol	I 41/a m d :2
Hall space group symbol	-I 4bd 2
Residual factor for all reflections	0.02
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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