Crystallography Open Database

Information card for entry 4344573

Preview

Coordinates	4344573.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	B8 K Li O13
Calculated formula	B8 K Li O13
Title of publication	Versatile Coordination Mode of LiNaB8O13 and α- and β-LiKB8O13 via the Flexible Assembly of Four-Connected B5O10 and B3O7 Groups.
Authors of publication	An, Donghai; Kong, Qingrong; Zhang, Min; Yang, Yun; Li, Danni; Yang, Zhihua; Pan, Shilie; Chen, Huimin; Su, Zhi; Sun, Yi; Mutailipu, Miriding
Journal of publication	Inorganic chemistry
Year of publication	2016
Journal volume	55
Journal issue	2
Pages of publication	552 - 554
a	10.9371 ± 0.0008 Å
b	7.7315 ± 0.0007 Å
c	11.2524 ± 0.001 Å
α	90°
β	96.887 ± 0.006°
γ	90°
Cell volume	944.64 ± 0.14 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.1062
Residual factor for significantly intense reflections	0.0569
Weighted residual factors for significantly intense reflections	0.1295
Weighted residual factors for all reflections included in the refinement	0.1513
Goodness-of-fit parameter for all reflections included in the refinement	1.045
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
175505 (current)	2016-02-04	cif/ Adding structures of 4344573 via cif-deposit CGI script.	4344573.cif