Crystallography Open Database

Information card for entry 4119735

4119734 << 4119735 >> 4119736

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Coordinates	4119735.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C55 H55 Cl2 N2 O P Ru
Calculated formula	C55 H51 Cl2 N2 O P Ru
Title of publication	The Activation Mechanism of Ru-Indenylidene Complexes in Olefin Metathesis
Authors of publication	César A. Urbina-Blanco; Albert Poater; Tomas Lebl; Simone Manzini; Alexandra M. Z. Slawin; Luigi Cavallo; Steven P. Nolan
Journal of publication	Journal of the American Chemical Society
Year of publication	2013
Journal volume	135
Pages of publication	7073 - 7079
a	11.734 ± 0.012 Å
b	15.573 ± 0.016 Å
c	17.953 ± 0.018 Å
α	107.109 ± 0.004°
β	103.411 ± 0.018°
γ	99.699 ± 0.018°
Cell volume	2949 ± 5 Å³
Cell temperature	93 ± 2 K
Ambient diffraction temperature	93 ± 2 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	0.1382
Residual factor for significantly intense reflections	0.1303
Weighted residual factors for significantly intense reflections	0.3615
Weighted residual factors for all reflections included in the refinement	0.3755
Goodness-of-fit parameter for all reflections included in the refinement	1.434
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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