Crystallography Open Database

Information card for entry 7215728

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Coordinates	7215728.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C8 H68 B18 K6 N6 O76 V12
Calculated formula	C8 B18 K6 N6 O76 V12
Title of publication	A series of new 3-D boratopolyoxovanadates containing five types of [KxOy]n building units
Authors of publication	An, Litao; Zhou, Jian; Xiao, Hong-Ping; Liu, Xing; Zou, Huahong; Pan, Chun-Yang; Liu, Meihua; Li, Jianhui
Journal of publication	CrystEngComm
Year of publication	2014
Journal volume	16
Journal issue	20
Pages of publication	4236
a	19.49 ± 0.02 Å
b	19.16 ± 0.02 Å
c	20.09 ± 0.02 Å
α	90°
β	91.785 ± 0.012°
γ	90°
Cell volume	7499 ± 13 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	7
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0559
Residual factor for significantly intense reflections	0.0482
Weighted residual factors for significantly intense reflections	0.1275
Weighted residual factors for all reflections included in the refinement	0.133
Goodness-of-fit parameter for all reflections included in the refinement	1.181
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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