Information card for entry 4089338

Structure parameters

• Common name: [RuCp(kappa^2^(P,P)-PPh~2~NHC~6~H~4~PPh~2~)(kappa^1^(N)-NH~2~Ph)] SbF~6~.solv (4.solv)
• Formula: C41 H37 F6 N2 P2 Ru Sb
• Calculated formula: C44.01 H37 F6 N2 P2 Ru Sb
• Title of publication: Reactions of the Cationic Fragments [RuCp(PPh2NHR)2]+and [RuTp(PPh2NHR)2]+(R = Ph,n-Pr) with Alkynes: Formation of Four-Membered Azaphosphacarbenes
• Authors of publication: Pavlik, Sonja; Mereiter, Kurt; Puchberger, Michael; Kirchner, Karl
• Journal of publication: Organometallics
• Year of publication: 2005
• Journal volume: 24
• Journal issue: 14
• Pages of publication: 3561
• a: 11.142 ± 0.0019 Å
• b: 15.037 ± 0.003 Å
• c: 24.94 ± 0.004 Å
• α: 90°
• β: 100.654 ± 0.003°
• γ: 90°
• Cell volume: 4106.5 ± 1.3 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• 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: 0.0735
• Residual factor for significantly intense reflections: 0.0468
• Weighted residual factors for significantly intense reflections: 0.097
• Weighted residual factors for all reflections included in the refinement: 0.1076
• Goodness-of-fit parameter for all reflections included in the refinement: 1.046
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No