Crystallography Open Database

Information card for entry 1560686

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Coordinates	1560686.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	As3 Cl Mn5 O12
Calculated formula	As3 Cl Mn5 O12
Title of publication	Crystal growth and crystal structures of six novel phases in the Mn/As/O/Cl(Br) system, as well as magnetic properties of α -Mn 3 (AsO 4 ) 2
Authors of publication	Weil, Matthias; Kremer, Reinhard K.
Journal of publication	Journal of Solid State Chemistry
Year of publication	2017
Journal volume	245
Pages of publication	115 - 126
a	9.8823 ± 0.0012 Å
b	9.8823 ± 0.0012 Å
c	6.2222 ± 0.0016 Å
α	90°
β	90°
γ	120°
Cell volume	526.25 ± 0.16 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	4
Space group number	176
Hermann-Mauguin space group symbol	P 63/m
Hall space group symbol	-P 6c
Residual factor for all reflections	0.0176
Residual factor for significantly intense reflections	0.0165
Weighted residual factors for significantly intense reflections	0.0396
Weighted residual factors for all reflections included in the refinement	0.04
Goodness-of-fit parameter for all reflections included in the refinement	1.14
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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