Crystallography Open Database

Information card for entry 7130972

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Coordinates	7130972.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C96 H112 Mn3 Mo27 Na5 O181
Calculated formula	C96 H112 Mn3 Mo27 Na5 O181
Title of publication	Supramolecular Hybrids of Chiral Waugh Polyoxometalate with Cyclodextrins
Authors of publication	Qi, Zhen-Qing; Wang, Ming-Yue; Shen, Jia-Chi; Lan, YouZhao; Jiang, Zhan-Guo; Zhan, Cai-Hong
Journal of publication	Chemical Communications
Year of publication	2022
a	19.361 ± 0.003 Å
b	37.863 ± 0.006 Å
c	35.71 ± 0.006 Å
α	90°
β	90°
γ	90°
Cell volume	26178 ± 7 Å³
Cell temperature	160 K
Ambient diffraction temperature	160 K
Number of distinct elements	6
Space group number	20
Hermann-Mauguin space group symbol	C 2 2 21
Hall space group symbol	C 2c 2
Residual factor for all reflections	0.1003
Residual factor for significantly intense reflections	0.079
Weighted residual factors for significantly intense reflections	0.2292
Weighted residual factors for all reflections included in the refinement	0.2501
Goodness-of-fit parameter for all reflections included in the refinement	1.037
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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