Crystallography Open Database

Information card for entry 7209918

7209917 << 7209918 >> 7209919

Preview

Coordinates	7209918.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	B La Mo O6
Calculated formula	B La Mo O6
Title of publication	Growth, structure and optical properties of a nonlinear optical crystal α-LaBMoO6
Authors of publication	Yu, Yan; Li, Lingyun; Lin, Zhoubin; Wang, Guofu
Journal of publication	CrystEngComm
Year of publication	2013
Journal volume	15
Journal issue	26
Pages of publication	5245
a	10.2863 ± 0.0003 Å
b	4.1579 ± 0.0001 Å
c	16.339 ± 0.0005 Å
α	90°
β	98.83 ± 0.003°
γ	90°
Cell volume	690.53 ± 0.03 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	4
Space group number	4
Hermann-Mauguin space group symbol	P 1 21 1
Hall space group symbol	P 2yb
Residual factor for all reflections	0.0382
Residual factor for significantly intense reflections	0.03
Weighted residual factors for significantly intense reflections	0.0707
Weighted residual factors for all reflections included in the refinement	0.079
Goodness-of-fit parameter for all reflections included in the refinement	0.999
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
180430 (current)	2016-03-26	cif/7/20/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 7/20/99.	7209918.cif
86876	2013-07-12	cif/ Adding structures of 7209918 via cif-deposit CGI script.	7209918.cif