Crystallography Open Database

Information card for entry 4343333

Preview

Coordinates	4343333.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	B Mo
Calculated formula	B0.85 Mo
Title of publication	Ternary Borides Cr2AlB2, Cr3AlB4, and Cr4AlB6: The First Members of the Series (CrB2)nCrAl with n = 1, 2, 3 and a Unifying Concept for Ternary Borides as MAB-Phases.
Authors of publication	Ade, Martin; Hillebrecht, Harald
Journal of publication	Inorganic chemistry
Year of publication	2015
Journal volume	54
Journal issue	13
Pages of publication	6122 - 6135
a	3.1418 ± 0.0002 Å
b	8.4961 ± 0.0006 Å
c	3.0721 ± 0.0002 Å
α	90°
β	90°
γ	90°
Cell volume	82.004 ± 0.009 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	2
Space group number	63
Hermann-Mauguin space group symbol	C m c m
Hall space group symbol	-C 2c 2
Residual factor for all reflections	0.0263
Residual factor for significantly intense reflections	0.0257
Weighted residual factors for significantly intense reflections	0.0645
Weighted residual factors for all reflections included in the refinement	0.0647
Goodness-of-fit parameter for all reflections included in the refinement	1.117
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
141347 (current)	2015-07-08	cif/ Updating files of 4343328, 4343329, 4343330, 4343331, 4343332, 4343333, 4343334, 4343335 Original log message: Adding full bibliography for 4343328--4343335.cif.	4343333.cif
139169	2015-06-14	cif/ Adding structures of 4343333 via cif-deposit CGI script.	4343333.cif