Crystallography Open Database

Information card for entry 1552094

1552093 << 1552094 >> 1552095

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Coordinates	1552094.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Ga7 H12 Na5 O6 S13
Calculated formula	Ga7 H12 Na5 O6 S13
Title of publication	Na5(Ga4S)(GaS4)3 6H2O: A three-dimensional gallium sulphide containing a novel octahedral building block
Authors of publication	Jack Rumble; Paz Vaqueiro
Journal of publication	Solid State Sciences
Year of publication	2011
Journal volume	13
Pages of publication	1137 - 1142
a	17.577 ± 0.004 Å
b	17.577 ± 0.004 Å
c	17.577 ± 0.004 Å
α	90°
β	90°
γ	90°
Cell volume	5430 ± 2 Å³
Cell temperature	290 K
Ambient diffraction temperature	290 K
Number of distinct elements	5
Space group number	219
Hermann-Mauguin space group symbol	F -4 3 c
Hall space group symbol	F -4a 2 3
Residual factor for all reflections	0.0732
Residual factor for significantly intense reflections	0.0319
Weighted residual factors for all reflections	0.0639
Weighted residual factors for significantly intense reflections	0.0313
Weighted residual factors for all reflections included in the refinement	0.0313
Goodness-of-fit parameter for all reflections included in the refinement	1.1206
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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