Crystallography Open Database

Information card for entry 7051195

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Coordinates	7051195.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C63 H86 Cl F6 O4 P3 Ru
Calculated formula	C63 H86 Cl F6 O4 P3 Ru
Title of publication	A cationic allenylideneruthenium(II) complex with two bulky hemilabile phosphine ligands
Authors of publication	Jung, Stefan; Brandt, Carsten D.; Werner, Helmut
Journal of publication	New Journal of Chemistry
Year of publication	2001
Journal volume	25
Journal issue	9
Pages of publication	1101
a	13.272 ± 0.003 Å
b	15.701 ± 0.003 Å
c	16.934 ± 0.003 Å
α	107 ± 0.03°
β	110.32 ± 0.03°
γ	98.76 ± 0.03°
Cell volume	3035.2 ± 1.6 Å³
Cell temperature	173 ± 2 K
Ambient diffraction temperature	173 ± 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	0.091
Residual factor for significantly intense reflections	0.0484
Weighted residual factors for significantly intense reflections	0.1093
Weighted residual factors for all reflections included in the refinement	0.1248
Goodness-of-fit parameter for all reflections included in the refinement	0.87
Diffraction radiation wavelength	0.71073 Å
Diffraction radiation type	MoKα
Has coordinates	Yes
Has disorder	Yes
Has F_obs	No

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