Crystallography Open Database

Information card for entry 7061165

Preview

Coordinates	7061165.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	B18 H56 O80 V12
Calculated formula	B18 H56 O80 V12
Title of publication	Water assisted high proton conductance in a pure-inorganic framework vanadoborate
Authors of publication	Liu, Xinxin; Zhang, Le; Zhao, SiSi; Guo, Biao; Zhao, Zhen
Journal of publication	New Journal of Chemistry
Year of publication	2022
Journal volume	46
Journal issue	3
Pages of publication	974 - 980
a	18.968 ± 0.004 Å
b	18.443 ± 0.004 Å
c	19.815 ± 0.004 Å
α	90°
β	92.77 ± 0.03°
γ	90°
Cell volume	6924 ± 3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
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	0.0868
Residual factor for significantly intense reflections	0.0631
Weighted residual factors for significantly intense reflections	0.1602
Weighted residual factors for all reflections included in the refinement	0.1753
Goodness-of-fit parameter for all reflections included in the refinement	1.077
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
272735 (current)	2022-02-04	cif/ Updating files of 7061165 Original log message: Adding full bibliography for 7061165.cif.	7061165.cif
271596	2021-12-23	cif/ Adding structures of 7061165 via cif-deposit CGI script.	7061165.cif