Crystallography Open Database

Information card for entry 7231396

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Coordinates	7231396.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C20 H52 Cu4 N12 O60 Si W12
Calculated formula	C20 H16 Cu4 N12 O51 Si W12
Title of publication	A stable polyoxometalate-based porous coordination polymer with high proton conductivity
Authors of publication	Luo, Yu-Hui; Yi, Li-Qiang; Lu, Jia-Ni; Dong, Long-Zhang; Lan, Ya-Qian
Journal of publication	CrystEngComm
Year of publication	2018
Journal volume	20
Journal issue	39
Pages of publication	6077
a	13.407 ± 0.006 Å
b	20.998 ± 0.009 Å
c	13.171 ± 0.006 Å
α	90°
β	104.296 ± 0.006°
γ	90°
Cell volume	3593 ± 3 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1333
Residual factor for significantly intense reflections	0.0802
Weighted residual factors for significantly intense reflections	0.1763
Weighted residual factors for all reflections included in the refinement	0.1984
Goodness-of-fit parameter for all reflections included in the refinement	1.035
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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