Information card for entry 4076116

Structure parameters

• Formula: C52 H56 N2 O P2 Ru
• Calculated formula: C52 H56 N2 O P2 Ru
• Title of publication: Ruthenium Hydride Complexes of 1,2-Dicyclohexylimidazol-2-ylidene
• Authors of publication: Burling, Suzanne; Kociok-Köhn, Gabriele; Mahon, Mary F.; Whittlesey, Michael K.; Williams, Jonathan M. J.
• Journal of publication: Organometallics
• Year of publication: 2005
• Journal volume: 24
• Journal issue: 24
• Pages of publication: 5868
• a: 9.093 ± 0.0001 Å
• b: 23.954 ± 0.0003 Å
• c: 20.592 ± 0.0003 Å
• α: 90°
• β: 91.258 ± 0.001°
• γ: 90°
• Cell volume: 4484.14 ± 0.1 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• 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: 0.1381
• Residual factor for significantly intense reflections: 0.0742
• Weighted residual factors for significantly intense reflections: 0.136
• Weighted residual factors for all reflections included in the refinement: 0.1531
• Goodness-of-fit parameter for all reflections included in the refinement: 1.107
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No