Crystallography Open Database

Information card for entry 4079929

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Coordinates	4079929.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C33 H50 Ru3
Calculated formula	C33 Ru3
Title of publication	Synthesis and Dynamic Properties of a Triruthenium Complex Containing μ3-η2(∥)-Ethyne and μ3-Methylidyne Ligands: Equilibrium of an Ethyne‒Hydrido Complex with a Nonclassical μ3-Vinyl Complex
Authors of publication	Tahara, Atsushi; Kajigaya, Mana; Takao, Toshiro; Suzuki, Hiroharu
Journal of publication	Organometallics
Year of publication	2013
Journal volume	32
Journal issue	1
Pages of publication	260
a	8.2947 ± 0.0005 Å
b	11.3999 ± 0.0006 Å
c	18.0571 ± 0.001 Å
α	85.1 ± 0.0014°
β	83.613 ± 0.0015°
γ	66.06 ± 0.0013°
Cell volume	1549.35 ± 0.15 Å³
Cell temperature	193 ± 2 K
Ambient diffraction temperature	193 ± 2 K
Number of distinct elements	3
Space group number	2
Hermann-Mauguin space group symbol	P -1
Hall space group symbol	-P 1
Residual factor for all reflections	0.0509
Residual factor for significantly intense reflections	0.0415
Weighted residual factors for significantly intense reflections	0.1084
Weighted residual factors for all reflections included in the refinement	0.117
Goodness-of-fit parameter for all reflections included in the refinement	1.068
Diffraction radiation wavelength	0.71069 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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