Crystallography Open Database

Information card for entry 1100929

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Coordinates	1100929.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 Cr6 N4 O100 P2 W18
Calculated formula	C12 Cr6 N4.02 O100 P2 W18
Title of publication	Structures and Sorption Properties of Ionic Crystals of Macrocation-Dawson-Type Polyoxometalates with Different Charges
Authors of publication	Uchida, Sayaka; Kawamoto, Ryosuke; Akatsuka, Takeo; Hikichi, Shiro; Mizuno, Noritaka
Journal of publication	Chemistry of Materials
Year of publication	2005
Journal volume	17
Journal issue	6
Pages of publication	1367 - 1375
a	16.009 ± 0.004 Å
b	16.009 ± 0.004 Å
c	21.785 ± 0.009 Å
α	90°
β	90°
γ	120°
Cell volume	4835 ± 2 Å³
Cell temperature	296.1 K
Number of distinct elements	6
Space group number	176
Hermann-Mauguin space group symbol	P 63/m
Hall space group symbol	-P 6c
Residual factor for significantly intense reflections	0.042
Weighted residual factors for all reflections included in the refinement	0.045
Goodness-of-fit parameter for all reflections included in the refinement	1.128
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Duplicate of	4000556
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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