Crystallography Open Database

Information card for entry 1562655

Preview

Coordinates	1562655.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C18 H84 B18 N12 O67 V12
Calculated formula	C18 H69 B18 N12 O67 V12
Title of publication	Hydrothermal syntheses, crystal structures and characterization of new vanadoborates: The novel decorated cage cluster [V6B22O44(OH)10]
Authors of publication	Liu, Xing; Zhou, Jian; An, Litao; Chen, Rong; Hu, Feilong; Tang, Qiuling
Journal of publication	Journal of Solid State Chemistry
Year of publication	2013
Journal volume	201
Pages of publication	79 - 84
a	21.6789 ± 0.001 Å
b	21.6789 ± 0.001 Å
c	13.5967 ± 0.0012 Å
α	90°
β	90°
γ	120°
Cell volume	5534 ± 0.6 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	6
Space group number	148
Hermann-Mauguin space group symbol	R -3 :H
Hall space group symbol	-R 3
Residual factor for all reflections	0.075
Residual factor for significantly intense reflections	0.0516
Weighted residual factors for significantly intense reflections	0.1416
Weighted residual factors for all reflections included in the refinement	0.1634
Goodness-of-fit parameter for all reflections included in the refinement	1.05
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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