Crystallography Open Database

Information card for entry 4318000

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Coordinates	4318000.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	MnFacac
Chemical name	Mnhfacac
Formula	C10 H6 F12 Mn O6
Calculated formula	C10 H6 F12 Mn O6
Title of publication	Oxidations of Hydrocarbons by Manganese(III) Tris(hexafluoroacetylacetonate)
Authors of publication	Jasmine R. Bryant; Janelle E. Taves; James M. Mayer
Journal of publication	Inorganic Chemistry
Year of publication	2002
Journal volume	41
Pages of publication	2769 - 2776
a	21.76 ± 0.003 Å
b	8.2466 ± 0.0013 Å
c	9.8746 ± 0.0007 Å
α	90°
β	96.346 ± 0.008°
γ	90°
Cell volume	1761.1 ± 0.4 Å³
Cell temperature	296 ± 2 K
Ambient diffraction temperature	296 ± 2 K
Number of distinct elements	5
Space group number	15
Hermann-Mauguin space group symbol	C 1 2/c 1
Hall space group symbol	-C 2yc
Residual factor for all reflections	0.0902
Residual factor for significantly intense reflections	0.0439
Weighted residual factors for significantly intense reflections	0.0943
Weighted residual factors for all reflections included in the refinement	0.1107
Goodness-of-fit parameter for all reflections included in the refinement	0.933
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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