Information card for entry 4062005

Structure parameters

• Common name: [RuCp(-C=CH2)-C(CH2)4C-eta2-CH=CH2)(SbPh3)]
• Formula: C33 H33 Ru Sb
• Calculated formula: C33 H33 Ru Sb
• SMILES: [Ru]123456([Sb](c7ccccc7)(c7ccccc7)c7ccccc7)([cH]7[cH]1[cH]2[cH]3[cH]47)C(=C)C1=C(CCCC1)[CH]5=[CH2]6
• Title of publication: Oxidative Coupling of Alkynes mediated by [RuCp(SbR3)(CH3CN)2]+ (R = Ph, n-Bu): Metallacyclopentatriene Intermediates and the Formation of Butadienyl Carbenes
• Authors of publication: Becker, Eva; Mereiter, Kurt; Puchberger, Michael; Schmid, Roland; Kirchner, Karl
• Journal of publication: Organometallics
• Year of publication: 2003
• a: 9.796 ± 0.003 Å
• b: 15.368 ± 0.005 Å
• c: 18.601 ± 0.006 Å
• α: 90°
• β: 101.82 ± 0.01°
• γ: 90°
• Cell volume: 2740.9 ± 1.5 ų
• Cell temperature: 297 ± 2 K
• Ambient diffraction temperature: 297 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No