Information card for entry 4069064

Structure parameters

• Formula: C38.37 H32.58 Cl0.79 Fe N4 Ru
• Calculated formula: C38.37 H32.58 Cl0.79 Fe N4 Ru
• Title of publication: Diruthenium Complexes of Axial Ferrocenyl−Polyynyl Ligands: The Cases of C6Fc and C8Fc
• Authors of publication: Xi, Bin; Xu, Guo-Lin; Fanwick, Phillip E.; Ren, Tong
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 7
• Pages of publication: 2338
• a: 11.0311 ± 0.0007 Å
• b: 18.9355 ± 0.0016 Å
• c: 21.081 ± 0.002 Å
• α: 70.969 ± 0.009°
• β: 80.291 ± 0.005°
• γ: 78.288 ± 0.003°
• Cell volume: 4051 ± 0.6 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.152
• Residual factor for significantly intense reflections: 0.089
• Weighted residual factors for significantly intense reflections: 0.211
• Weighted residual factors for all reflections included in the refinement: 0.236
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MO-Kα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No