Crystallography Open Database

Information card for entry 4336300

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Coordinates	4336300.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C59 H65 B Cl2 F24 N2 O2 P2 Ru
Calculated formula	C59.001 H65 B Cl2 F24 N2 O2 P2 Ru
Title of publication	Ru(0) and Ru(II) Nitrosyl Pincer Complexes: Structure, Reactivity, and Catalytic Activity
Authors of publication	Eran Fogler; Mark A. Iron; Jing Zhang; Yehoshoa Ben-David; Yael Diskin-Posner; Gregory Leitus; Linda J. W. Shimon; David Milstein
Journal of publication	Inorganic Chemistry
Year of publication	2013
Journal volume	52
Pages of publication	11469 - 11479
a	13.7611 ± 0.0005 Å
b	23.5911 ± 0.0007 Å
c	20.3726 ± 0.0006 Å
α	90°
β	97.092 ± 0.002°
γ	90°
Cell volume	6563.1 ± 0.4 Å³
Cell temperature	100 ± 2 K
Ambient diffraction temperature	100 ± 2 K
Number of distinct elements	9
Space group number	14
Hermann-Mauguin space group symbol	P 1 21/c 1
Hall space group symbol	-P 2ybc
Residual factor for all reflections	0.0982
Residual factor for significantly intense reflections	0.0531
Weighted residual factors for significantly intense reflections	0.1259
Weighted residual factors for all reflections included in the refinement	0.1501
Goodness-of-fit parameter for all reflections included in the refinement	1.024
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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