Crystallography Open Database

Information card for entry 4066292

Preview

Coordinates	4066292.cif
Original paper (by DOI)	HTML

Structure parameters

Formula	C37.5 H47 Cl2 N2 O P Ru
Calculated formula	C37.5 H46 Cl2 N2 O P Ru
Title of publication	Synthesis, Characterization, and H-Bonding Abilities of Ruthenium(II) Complexes Bearing Bidentate NR,NH-Carbene/Phosphine Ligands†
Authors of publication	Hahn, F. Ekkehardt; Naziruddin, Abbas Raja; Hepp, Alexander; Pape, Tania
Journal of publication	Organometallics
Year of publication	2010
Journal volume	29
Journal issue	21
Pages of publication	5283
a	28.9982 ± 0.0011 Å
b	28.9982 ± 0.0011 Å
c	16.8529 ± 0.0008 Å
α	90°
β	90°
γ	90°
Cell volume	14171.5 ± 1 Å³
Cell temperature	153 ± 2 K
Ambient diffraction temperature	153 ± 2 K
Number of distinct elements	7
Space group number	88
Hermann-Mauguin space group symbol	I 41/a :2
Hall space group symbol	-I 4ad
Residual factor for all reflections	0.0736
Residual factor for significantly intense reflections	0.0467
Weighted residual factors for significantly intense reflections	0.1101
Weighted residual factors for all reflections included in the refinement	0.1246
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	No
Has F_obs	No

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