Crystallography Open Database

Information card for entry 2239035

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Structure parameters

Chemical name	Lithium/sodium iron(III) bis[orthomolybdate(VI)]
Formula	Fe Li0.37 Mo2 Na0.63 O8
Calculated formula	Fe Li0.369 Mo2 Na0.631 O8
Title of publication	β-Li~0.37~Na~0.63~Fe(MoO~4~)~2~
Authors of publication	Souilem, Amira; Zid, Mohamed Faouzi; Driss, Ahmed
Journal of publication	Acta Crystallographica Section E
Year of publication	2014
Journal volume	70
Journal issue	2
Pages of publication	i9 - i10
a	6.886 ± 0.0008 Å
b	7.256 ± 0.0009 Å
c	7.3786 ± 0.0009 Å
α	91.06 ± 0.006°
β	110.933 ± 0.009°
γ	105.661 ± 0.009°
Cell volume	328.84 ± 0.07 Å³
Cell temperature	298 ± 2 K
Ambient diffraction temperature	298 ± 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	0.0204
Residual factor for significantly intense reflections	0.0195
Weighted residual factors for significantly intense reflections	0.051
Weighted residual factors for all reflections included in the refinement	0.0514
Goodness-of-fit parameter for all reflections included in the refinement	1.187
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	Yes

Version history

Revision	Date	Message	Files
181890 (current)	2016-04-06	hkl/2/23/ (antanas@echidna) Adding IUCr specific svn headers to multiple entries in subrange 2/23/90.	2239035.cif 2239035.hkl
181309	2016-04-03	hkl/2/23/ (antanas@echidna) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23/90.	2239035.cif 2239035.hkl
176798	2016-02-21	cif/2/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 2/23.	2239035.cif 2239035.hkl
104874	2014-03-11	cif/ hkl/ Adding structures of 2239035 via cif-deposit CGI script.	2239035.cif 2239035.hkl