Crystallography Open Database

Information card for entry 4110443

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Coordinates	4110443.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C49 H74 B O1.5 P5 Ru
Calculated formula	C49 H74 B O1.5 P5 Ru
Title of publication	Asymmetric Catalytic Synthesis of P-Stereogenic Phosphines via a Nucleophilic Ruthenium Phosphido Complex
Authors of publication	Vincent S. Chan; Ian C. Stewart; Robert G. Bergman; F. Dean Toste
Journal of publication	Journal of the American Chemical Society
Year of publication	2006
Journal volume	128
Pages of publication	2786 - 2787
a	16.354 ± 0.001 Å
b	13.2884 ± 0.0009 Å
c	22.9689 Å
α	90°
β	95.501 ± 0.002°
γ	90°
Cell volume	4968.6 ± 0.5 Å³
Cell temperature	273.2 K
Number of distinct elements	6
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/n 1
Hall space group symbol	-P 2yn
Residual factor for all reflections	0.0675
Residual factor for significantly intense reflections	0.0402
Weighted residual factors for all reflections	0.0567
Weighted residual factors for all reflections included in the refinement	0.0515
Goodness-of-fit parameter for all reflections included in the refinement	1.68
Diffraction radiation wavelength	0.7107 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	No
Has F_obs	No

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