Crystallography Open Database

Information card for entry 4074639

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Coordinates	4074639.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C37 H38 Cl2 O4 Ru2
Calculated formula	C37 H38 Cl2 O4 Ru2
Title of publication	Reactions of CpArCHCHArCp with Ru3(CO)12: An Unexpected Cleavage of a Bridging C‒C Bond and Coupling of the Two Cyclopentadienyl Rings to Fulvalene Diruthenium Complexes
Authors of publication	Li, Bin; Wang, Baiquan; Xu, Shansheng; Zhou, Xiuzhong; Song, Haibin
Journal of publication	Organometallics
Year of publication	2006
Journal volume	25
Journal issue	5
Pages of publication	1158 - 1166
a	18.902 ± 0.006 Å
b	17.305 ± 0.005 Å
c	21.96 ± 0.007 Å
α	90°
β	95.924 ± 0.007°
γ	90°
Cell volume	7145 ± 4 Å³
Cell temperature	293 ± 2 K
Ambient diffraction temperature	293 ± 2 K
Number of distinct elements	5
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	0.1599
Residual factor for significantly intense reflections	0.0578
Weighted residual factors for significantly intense reflections	0.1025
Weighted residual factors for all reflections included in the refinement	0.1522
Goodness-of-fit parameter for all reflections included in the refinement	0.973
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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