Information card for entry 7715301

Structure parameters

• Formula: C36 H22 O4 Rh2
• Calculated formula: C36 H22 O4 Rh2
• SMILES: [c]12([cH]3[c]4([c]567[c]891[c]1([cH]%10[c]5(c5ccccc5)[Rh]791%10(C#[O])(C#[O])[Rh]23468(C#[O])C#[O])c1ccccc1)c1ccccc1)c1ccccc1
• Title of publication: Twinned <i>versus</i> linked organometallics - bimetallic "half-baguette" pentalenide complexes of Rh(I).
• Authors of publication: Sanderson, Hugh J.; Kociok-Köhn, Gabriele; McMullin, Claire L.; Hintermair, Ulrich
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2024
• Journal volume: 53
• Journal issue: 13
• Pages of publication: 5881 - 5899
• a: 12.7037 ± 0.0002 Å
• b: 10.34448 ± 0.00016 Å
• c: 22.6879 ± 0.0004 Å
• α: 90°
• β: 103.76 ± 0.0016°
• γ: 90°
• Cell volume: 2895.92 ± 0.08 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150.01 ± 0.1 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0266
• Residual factor for significantly intense reflections: 0.0231
• Weighted residual factors for significantly intense reflections: 0.0509
• Weighted residual factors for all reflections included in the refinement: 0.0525
• Goodness-of-fit parameter for all reflections included in the refinement: 1.111
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No