Crystallography Open Database

Information card for entry 2312283

Preview

Coordinates	2312283.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	Al0.08 B Fe1.183 Mg1.737 O5
Calculated formula	Al0.08 B Fe1.1835 Mg1.7365 O5
Title of publication	Crystal structure refinement, low- and high-temperature X-ray diffraction and Mössbauer spectroscopy study of the oxoborate ludwigite from the Iten'yurginskoe deposit.
Authors of publication	Biryukov, Yaroslav P.; Zinnatullin, Almaz L.; Levashova, Irina O.; Shablinskii, Andrey P.; Bubnova, Rimma S.; Vagizov, Farit G.; Ugolkov, Valery L.; Filatov, Stanislav K.; Pekov, Igor V.
Journal of publication	Acta crystallographica Section B, Structural science, crystal engineering and materials
Year of publication	2023
Journal volume	79
Journal issue	5
a	9.2532 ± 0.0014 Å
b	12.3025 ± 0.0018 Å
c	3.0256 ± 0.0005 Å
α	90°
β	90°
γ	90°
Cell volume	344.43 ± 0.09 Å³
Cell temperature	293 K
Ambient diffraction temperature	293 K
Number of distinct elements	5
Space group number	55
Hermann-Mauguin space group symbol	P b a m
Hall space group symbol	-P 2 2ab
Residual factor for all reflections	0.073
Residual factor for significantly intense reflections	0.0469
Weighted residual factors for significantly intense reflections	0.0397
Weighted residual factors for all reflections included in the refinement	0.0434
Goodness-of-fit parameter for significantly intense reflections	1.72
Goodness-of-fit parameter for all reflections included in the refinement	1.53
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
286220 (current)	2023-09-06	cif/ hkl/ Adding structures of 2312283 via cif-deposit CGI script.	2312283.cif