Crystallography Open Database

Information card for entry 4309847

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Coordinates	4309847.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C24 H21 F3 N4 O6 Ru S2
Calculated formula	C24 H21 F3 N4 O6 Ru S2
Title of publication	Designing Molecular Bistability in Ruthenium Dimethyl Sulfoxide Complexes
Authors of publication	Aaron A. Rachford; Jeffrey L. Petersen; Jeffrey J. Rack
Journal of publication	Inorganic Chemistry
Year of publication	2005
Journal volume	44
Pages of publication	8065 - 8075
a	12.84 ± 0.0008 Å
b	8.6442 ± 0.0005 Å
c	23.889 ± 0.0015 Å
α	90°
β	93.957 ± 0.001°
γ	90°
Cell volume	2645.2 ± 0.3 Å³
Cell temperature	295 ± 2 K
Ambient diffraction temperature	295 ± 2 K
Number of distinct elements	7
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0505
Residual factor for significantly intense reflections	0.0351
Weighted residual factors for significantly intense reflections	0.0823
Weighted residual factors for all reflections included in the refinement	0.0888
Goodness-of-fit parameter for all reflections included in the refinement	1.025
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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