Information card for entry 1513286

Structure parameters

• Formula: C40 H34 B F4 Rh
• Calculated formula: C40 H34 B F4 Rh
• SMILES: [Rh]12345678([cH]9[cH]1[cH]2[cH]3[cH]4[c]59[B](c1ccccc1)(c1ccccc1)c1ccccc1)[C]1(=[C]8(C2[C]6(=[C]7(C1c1c2c(F)c(F)c(F)c1F)C)C)C)C
• Title of publication: Polymerization of Phenylacetylenes with Rhodium Zwitterionic Complexes: Enhanced Catalytic Activity by π-Acidic Diene Ligands
• Authors of publication: Onishi, Naoya; Shiotsuki, Masashi; Sanda, Fumio; Masuda, Toshio
• Journal of publication: Macromolecules
• Year of publication: 2009
• Journal volume: 42
• Journal issue: 12
• Pages of publication: 4071
• a: 10.267 ± 0.006 Å
• b: 11.174 ± 0.007 Å
• c: 15.202 ± 0.01 Å
• α: 101.382 ± 0.005°
• β: 106.071 ± 0.008°
• γ: 97.165 ± 0.007°
• Cell volume: 1612.9 ± 1.7 ų
• Cell temperature: 143.15 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0663
• Weighted residual factors for all reflections included in the refinement: 0.072
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No