Crystallography Open Database

Information card for entry 7220795

7220794 << 7220795 >> 7220796

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Coordinates	7220795.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Fe4 H80 O106 Pr2 Sb2 W18
Calculated formula	Fe4 O106 Pr2 Sb2 W18
Title of publication	The first purely inorganic polyoxotungstates constructed from dimeric tungstoantimonate-based iron‒rare-earth heterometallic fragments
Authors of publication	Chen, Lijuan; Cao, Jing; Li, Xinghua; Ma, Xing; Luo, Jie; Zhao, Junwei
Journal of publication	CrystEngComm
Year of publication	2015
Journal volume	17
Journal issue	27
Pages of publication	5002
a	12.7448 ± 0.001 Å
b	12.7563 ± 0.0009 Å
c	16.1414 ± 0.0012 Å
α	78.129 ± 0.001°
β	74.374 ± 0.001°
γ	83.622 ± 0.001°
Cell volume	2468.9 ± 0.3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0613
Residual factor for significantly intense reflections	0.0522
Weighted residual factors for significantly intense reflections	0.1337
Weighted residual factors for all reflections included in the refinement	0.1393
Goodness-of-fit parameter for all reflections included in the refinement	1.007
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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