Information card for entry 4060752

Structure parameters

• Formula: C48 H41 Cl4 Co Fe O9 P2 Ru2
• Calculated formula: C48 H41 Cl4 Co Fe O9 P2 Ru2
• SMILES: [Ru]12345([Ru]67([Co]81([C]3([Fe]139%10(C#[O])(C#[O])[c]%11([c]%10([c]9([c]3([c]1%11C)C)C)C)C)=[C]468)(C#[O])(C5=O)C7=O)([P](C[P]2(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(C#[O])C#[O])(C#[O])C#[O].ClCCl.ClCCl
• Title of publication: Formal Hydrogenation of a Permetalated Ethene, (μ4-C\δb C)Fe2Ru2(η5-C5Me5)2(CO)8(dppm), via Successive Protonation-Hydride Reduction Leading to C2Hn Cluster Compounds
• Authors of publication: Masako Terada; Munetaka Akita
• Journal of publication: Organometallics
• Year of publication: 2003
• Journal volume: 22
• Pages of publication: 355 - 364
• a: 11.4541 ± 0.0003 Å
• b: 19.4961 ± 0.0006 Å
• c: 22.7347 ± 0.0006 Å
• α: 90°
• β: 92.419 ± 0.002°
• γ: 90°
• Cell volume: 5072.4 ± 0.2 ų
• Cell temperature: 213 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.0413
• Weighted residual factors for all reflections included in the refinement: 0.127
• Goodness-of-fit parameter for all reflections included in the refinement: 0.789
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No