Information card for entry 4108745

Structure parameters

• Formula: C24 H30 Ga2 I4 O4 Ru2
• Calculated formula: C24 H30 Ga2 I4 O4 Ru2
• SMILES: C([Ru]1234([c]5([c]1([c]2([c]3([c]45C)C)C)C)C)([Ga]1(I)[I][Ga](I)([I]1)[Ru]1234(C#[O])(C#[O])[c]5([c]1([c]2([c]3([c]45C)C)C)C)C)C#[O])#[O]
• Title of publication: Cationic Terminal Gallylene Complexes by Halide Abstraction: Coordination Chemistry of a Valence Isoelectronic Analogue of CO and N2
• Authors of publication: Natalie D. Coombs; Dragoslav Vidovic; Joanna K. Day; Amber L. Thompson; Delphine D. Le Pevelen; Andreas Stasch; William Clegg; Luca Russo; Louise Male; Michael B. Hursthouse; David J. Willock; Simon Aldridge
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2008
• Journal volume: 130
• Pages of publication: 16111 - 16124
• a: 8.6253 ± 0.0002 Å
• b: 9.8332 ± 0.0002 Å
• c: 11.6061 ± 0.0002 Å
• α: 73.355 ± 0.001°
• β: 73.115 ± 0.001°
• γ: 67.537 ± 0.001°
• Cell volume: 853.15 ± 0.03 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0341
• Residual factor for significantly intense reflections: 0.0317
• Weighted residual factors for significantly intense reflections: 0.0803
• Weighted residual factors for all reflections included in the refinement: 0.0815
• Goodness-of-fit parameter for all reflections included in the refinement: 1.162
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No