Crystallography Open Database

Information card for entry 4341867

Preview

Coordinates	4341867.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C3 Al Y3
Calculated formula	C3 Al Y3
Title of publication	Crystal Structure and Electronic Properties of Y3AlC3.
Authors of publication	Kotyrba, Martin R.; Cuervo-Reyes, Eduardo; Nesper, Reinhard
Journal of publication	Inorganic chemistry
Year of publication	2015
Journal volume	54
Journal issue	3
Pages of publication	710 - 712
a	7.0256 ± 0.0011 Å
b	3.5647 ± 0.0006 Å
c	9.9585 ± 0.0016 Å
α	90°
β	90°
γ	90°
Cell volume	249.4 ± 0.07 Å³
Cell temperature	293 K
Ambient diffraction temperature	293 K
Number of distinct elements	3
Space group number	51
Hermann-Mauguin space group symbol	P m m a
Hall space group symbol	-P 2a 2a
Residual factor for all reflections	0.0247
Residual factor for significantly intense reflections	0.0208
Weighted residual factors for significantly intense reflections	0.05
Weighted residual factors for all reflections included in the refinement	0.0512
Goodness-of-fit parameter for all reflections included in the refinement	1.038
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Diffraction radiation X-ray symbol	K-L~3~
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
179521 (current)	2016-03-24	cif/4/34/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/34/18.	4341867.cif
130538	2015-02-04	cif/ Updating files of 4341867 Original log message: Adding full bibliography for 4341867.cif.	4341867.cif
128258	2014-12-06	cif/ Adding structures of 4341867 via cif-deposit CGI script.	4341867.cif