Crystallography Open Database

Information card for entry 4347716

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Coordinates	4347716.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C27 H38 F12 N10 P2 Ru
Calculated formula	C27 H38 F12 N10 P2 Ru
Title of publication	Controlling Coordination Geometries: Ru-Carbene Complexes with Tetra-NHC Ligands.
Authors of publication	Hollering, Manuela; Weiss, Daniel T.; Bitzer, Mario J.; Jandl, Christian; Kühn, Fritz E
Journal of publication	Inorganic chemistry
Year of publication	2016
Journal volume	55
Journal issue	12
Pages of publication	6010 - 6017
a	9.3216 ± 0.0004 Å
b	11.4705 ± 0.0006 Å
c	17.2077 ± 0.0009 Å
α	85.474 ± 0.002°
β	87.981 ± 0.002°
γ	87.135 ± 0.002°
Cell volume	1830.97 ± 0.16 Å³
Cell temperature	100 K
Ambient diffraction temperature	100 K
Number of distinct elements	6
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.049
Residual factor for significantly intense reflections	0.038
Weighted residual factors for significantly intense reflections	0.0925
Weighted residual factors for all reflections included in the refinement	0.0971
Goodness-of-fit parameter for all reflections included in the refinement	1.106
Diffraction radiation probe	x-ray
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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