Crystallography Open Database

Information card for entry 4080921

Preview

Coordinates	4080921.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H45 Cl3 F12 N6 P2 Ru2
Calculated formula	C33 H45 Cl3 F12.01 N6 P2 Ru2
Title of publication	Pyrazolato-Bridged Dinuclear Complexes of Ruthenium(II) and Rhodium(III) with N-Heterocyclic Carbene Ligands: Synthesis, Characterization, and Electrochemical Properties
Authors of publication	Reindl, Stefan A.; Pöthig, Alexander; Drees, Markus; Bechlars, Bettina; Herdtweck, Eberhardt; Herrmann, Wolfgang A.; Kühn, Fritz E.
Journal of publication	Organometallics
Year of publication	2013
Journal volume	32
Journal issue	15
Pages of publication	4082
a	21.4773 ± 0.0004 Å
b	32.3885 ± 0.0006 Å
c	16.0489 ± 0.0006 Å
α	90°
β	107.321 ± 0.001°
γ	90°
Cell volume	10657.6 ± 0.5 Å³
Cell temperature	173 K
Ambient diffraction temperature	173 K
Number of distinct elements	7
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	0.0541
Residual factor for significantly intense reflections	0.041
Weighted residual factors for significantly intense reflections	0.1048
Weighted residual factors for all reflections included in the refinement	0.1096
Goodness-of-fit parameter for all reflections included in the refinement	1.032
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

Version history

Revision	Date	Message	Files
178698 (current)	2016-03-21	cif/4/08/ (antanas@kurmis) Replacing _[local]_cod_* tags with their equivalents from the COD CIF dictionary in multiple entries in subrange 4/08/09.	4080921.cif
107967	2014-03-25	cif/4 Changing the entity to the proper non-English character for many entries in subdir 4	4080921.cif
87950	2013-08-27	cif/ Adding structures of 4080921, 4080922, 4080923, 4080924 via cif-deposit CGI script.	4080921.cif