Crystallography Open Database

Information card for entry 2311411

Preview

Coordinates	2311411.cif
Original IUCr paper	HTML

Structure parameters

Chemical name	Lithium tetrachloridoaluminate
Formula	Al Cl4 Li
Calculated formula	Al Cl4 Li
Title of publication	Lithium tetra-chlorido-aluminate, LiAlCl<sub>4</sub>: a new polymorph (<i>oP</i>12, <i>Pmn</i>2<sub>1</sub>) with Li<sup>+</sup> in tetra-hedral inter-stices.
Authors of publication	Prömper, Stephan W; Frank, Walter
Journal of publication	Acta crystallographica. Section E, Crystallographic communications
Year of publication	2017
Journal volume	73
Journal issue	Pt 10
Pages of publication	1426 - 1429
a	7.8273 ± 0.001 Å
b	6.4466 ± 0.001 Å
c	6.1304 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	309.34 ± 0.07 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 K
Number of distinct elements	3
Space group number	31
Hermann-Mauguin space group symbol	P m n 21
Hall space group symbol	P 2ac -2
Residual factor for all reflections	0.0309
Residual factor for significantly intense reflections	0.0282
Weighted residual factors for significantly intense reflections	0.074
Weighted residual factors for all reflections included in the refinement	0.0745
Goodness-of-fit parameter for all reflections included in the refinement	1.207
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
245864 (current)	2019-12-25	cif/ Adding structures of 2311411 via cif-deposit CGI script.	2311411.cif