Crystallography Open Database

Information card for entry 1548208

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Coordinates	1548208.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C40 H54 N14 O41 W12 Zn3
Calculated formula	C40 H54 N14 O41 W12 Zn3
Title of publication	Polyoxometalate-based homochiral metal-organic frameworks for tandem asymmetric transformation of cyclic carbonates from olefins
Authors of publication	Qiuxia Han; Bo Qi; Weimin Ren; Cheng He; Jingyang Niu; Chunying Duan
Journal of publication	Nature Communications
Year of publication	2015
Journal volume	6
Pages of publication	10007
a	15.088 ± 0.0004 Å
b	13.2353 ± 0.0003 Å
c	18.0221 ± 0.0005 Å
α	90°
β	94.414 ± 0.002°
γ	90°
Cell volume	3588.23 ± 0.16 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0662
Residual factor for significantly intense reflections	0.0607
Weighted residual factors for significantly intense reflections	0.1447
Weighted residual factors for all reflections included in the refinement	0.1479
Goodness-of-fit parameter for all reflections included in the refinement	1.009
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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