Crystallography Open Database

Information card for entry 7702700

Preview

Coordinates	7702700.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C52 H44 Cl2 N10 O12 Ru2
Calculated formula	C52 H40 Cl2 N10 O12 Ru2
Title of publication	A dinuclear bis(bipyridine)ruthenium(ii) complex, [(bpy)2RuII{L2‒}RuII(bpy)2]2+, incorporating an unusual non-innocent bridging ligand containing a p-benzoquinonediimine fragment: synthesis, structure, redox, and UV/VIS/NIR and EPR spectroelectrochemical properties
Authors of publication	Chakraborty, Soma; Laye, Rebecca H.; Paul, Rowena L.; Gonnade, Rajesh G.; Puranik, Vedavati G.; Ward, Michael D.; Lahiri, Goutam Kumar
Journal of publication	Journal of the Chemical Society, Dalton Transactions
Year of publication	2002
Journal issue	6
Pages of publication	1172
a	12.32 ± 0.004 Å
b	14.781 ± 0.005 Å
c	15.394 ± 0.005 Å
α	83.096 ± 0.005°
β	77.626 ± 0.005°
γ	73.646 ± 0.005°
Cell volume	2622 ± 1.5 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 2 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	0.156
Residual factor for significantly intense reflections	0.0772
Weighted residual factors for significantly intense reflections	0.1912
Weighted residual factors for all reflections included in the refinement	0.2376
Goodness-of-fit parameter for all reflections included in the refinement	0.957
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

Version history

Revision	Date	Message	Files
243970 (current)	2019-11-28	cif/ Adding structures of 7702700, 7702701 via cif-deposit CGI script.	7702700.cif