Crystallography Open Database

Information card for entry 2023163

2023162 << 2023163 >> 2023164

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Coordinates	2023163.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	Caesium thallium chloride phosphotungstate
Formula	Cl30 Cs36 O160 P4 Tl2 W48
Calculated formula	Cl30 Cs36 O160 P4 Tl2 W48
Title of publication	Crystal structure of hexachlorothallate within a caesium chloride–phosphotungstate lattice Cs9(TlCl6)(PW12O40)2·9CsCl
Authors of publication	Deblonde, Gauthier; Colliard, Ian
Journal of publication	Acta Crystallographica Section E Crystallographic Communications
Year of publication	2024
Journal volume	80
Journal issue	7
a	22.9963 ± 0.0003 Å
b	22.9963 ± 0.0003 Å
c	22.9963 ± 0.0003 Å
α	90°
β	90°
γ	90°
Cell volume	12161.1 ± 0.3 Å³
Cell temperature	298 K
Ambient diffraction temperature	298 K
Number of distinct elements	6
Space group number	225
Hermann-Mauguin space group symbol	F m -3 m
Hall space group symbol	-F 4 2 3
Residual factor for all reflections	0.0438
Residual factor for significantly intense reflections	0.0416
Weighted residual factors for significantly intense reflections	0.1147
Weighted residual factors for all reflections included in the refinement	0.1158
Goodness-of-fit parameter for all reflections included in the refinement	1.197
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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