Crystallography Open Database

Information card for entry 4342498

Preview

Coordinates	4342498.cif
Original paper (by DOI)	HTML

Structure parameters

Chemical name	CrSe2
Formula	Cr Se2
Calculated formula	Cr Se2
Title of publication	(BiSe)1.23CrSe2 and (BiSe)1.22(Cr1.2Se2)2: Magnetic Anisotropy in the First Structurally Characterized Bi-Se-Cr Ternary Compounds.
Authors of publication	Clarke, Samantha M.; Freedman, Danna E.
Journal of publication	Inorganic chemistry
Year of publication	2015
Journal volume	54
Journal issue	6
Pages of publication	2765 - 2771
a	6.1705 ± 0.0011 Å
b	3.6053 ± 0.0007 Å
c	11.472 ± 0.002 Å
α	90°
β	95.218 ± 0.015°
γ	90°
Cell volume	254.15 ± 0.08 Å³
Cell temperature	250 K
Ambient diffraction temperature	250 K
Number of distinct elements	2
Space group number	12
Hermann-Mauguin space group symbol	C 1 2/m 1
Hall space group symbol	-C 2y
Residual factor for all reflections	0.188
Residual factor for significantly intense reflections	0.1398
Weighted residual factors for significantly intense reflections	0.3631
Weighted residual factors for all reflections included in the refinement	0.3917
Goodness-of-fit parameter for all reflections included in the refinement	1.447
Diffraction radiation probe	x-ray
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
179527 (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 4/34/24.	4342498.cif
134769	2015-04-04	cif/ Updating files of 4342497, 4342498, 4342499, 4342500, 4342501, 4342502 Original log message: Adding full bibliography for 4342497--4342502.cif.	4342498.cif
132332	2015-02-24	cif/ Adding structures of 4342497, 4342498, 4342499, 4342500, 4342501, 4342502 via cif-deposit CGI script.	4342498.cif