Crystallography Open Database

Information card for entry 7055443

Preview

Coordinates	7055443.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Al4.68 B8 La2 O22
Calculated formula	Al4.68 B8 La2 O22
Title of publication	Crystal growth, structure and optical properties of a new acentric crystal La2Al4.68B8O22with a short UV absorption edge
Authors of publication	Guo, Shu; Liu, Lijuan; Xia, Mingjun; Wang, Xiaoyang; Bai, Lei; Xu, Bo; Huang, Qian; Chen, Chuangtian
Journal of publication	New J. Chem.
Year of publication	2016
Journal volume	40
Journal issue	6
Pages of publication	4870
a	4.6149 ± 0.0007 Å
b	4.6149 ± 0.0007 Å
c	18.72 ± 0.004 Å
α	90°
β	90°
γ	120°
Cell volume	345.27 ± 0.1 Å³
Cell temperature	153.15 K
Ambient diffraction temperature	153.15 K
Number of distinct elements	4
Space group number	189
Hermann-Mauguin space group symbol	P -6 2 m
Hall space group symbol	P -6 -2
Residual factor for all reflections	0.0409
Residual factor for significantly intense reflections	0.0379
Weighted residual factors for significantly intense reflections	0.1273
Weighted residual factors for all reflections included in the refinement	0.1322
Goodness-of-fit parameter for all reflections included in the refinement	1.234
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
183725 (current)	2016-06-18	cif/ Updating files of 7055443 Original log message: Adding full bibliography for 7055443.cif.	7055443.cif
180676	2016-04-01	cif/ Adding structures of 7055443 via cif-deposit CGI script.	7055443.cif