Crystallography Open Database

Information card for entry 4089382

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Coordinates	4089382.cif
Original paper (by DOI)	HTML

Structure parameters

Common name	unimc10
Formula	C68 H64 F12 N2 O13 Ru4 S4
Calculated formula	C68 H64 F12 N2 O13 Ru4 S4
Title of publication	Diruthenium Naphthalene and Anthracene Complexes Containing a Doubly Linked Dicyclopentadienyl Ligand
Authors of publication	Salembier, Hélori; Mauldin, Joshua; Hammond, Tom; Wallace, Rodney; Alqassab, Essa; Hall, Michael B.; Pérez, Lisa M.; Chen, Yuen-Jing Alexis; Turner, Katherine E.; Bockoven, Eric; Brennessel, William; Chin, Robert M.
Journal of publication	Organometallics
Year of publication	2012
Journal volume	31
Journal issue	13
Pages of publication	4838
a	12.721 ± 0.002 Å
b	15.09 ± 0.003 Å
c	18.288 ± 0.004 Å
α	93.529 ± 0.004°
β	90.48 ± 0.003°
γ	106.934 ± 0.004°
Cell volume	3350.7 ± 1.1 Å³
Cell temperature	100 ± 0.1 K
Ambient diffraction temperature	100 ± 0.1 K
Number of distinct elements	7
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0699
Residual factor for significantly intense reflections	0.0545
Weighted residual factors for significantly intense reflections	0.1326
Weighted residual factors for all reflections included in the refinement	0.1398
Goodness-of-fit parameter for all reflections included in the refinement	1.068
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
243625 (current)	2019-11-26	cif/ Adding structures of 4089380, 4089381, 4089382 via cif-deposit CGI script.	4089382.cif