Crystallography Open Database

Information card for entry 4322454

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Coordinates	4322454.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C12 F18 Mo S6
Calculated formula	C8 F12 Mo0.666667 S4
Title of publication	Syntheses of Metal Dithiolene Complexes from Thiometalates by Induced Internal Redox Reactions
Authors of publication	Kun Wang; Jonathan M. McConnachie; Edward I. Stiefel
Journal of publication	Inorganic Chemistry
Year of publication	1999
Journal volume	38
Pages of publication	4334 - 4341
a	9.6795 ± 0.0014 Å
b	9.6795 ± 0.0014 Å
c	13.951 ± 0.003 Å
α	90°
β	90°
γ	120°
Cell volume	1132 ± 0.3 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 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	0.1062
Residual factor for significantly intense reflections	0.1036
Weighted residual factors for all reflections	0.2854
Weighted residual factors for significantly intense reflections	0.2836
Goodness-of-fit parameter for all reflections	1.144
Goodness-of-fit parameter for significantly intense reflections	1.177
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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