Information card for entry 4066871

Structure parameters

• Formula: C24 H26 Cl F6 N6 P Ru S3
• Calculated formula: C24 H26 Cl F6 N6 P Ru S3
• Title of publication: Photophysical and Theoretical Studies of Ruthenium(II)−Acetylide and −Cyanide Complexes with Aromatic Diimine and Trithiacyclononane
• Authors of publication: Wong, Chun-Yuen; Lai, Lo-Ming; Chan, Siu-Chung; Tai, Lai-Hung
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 23
• Pages of publication: 6259
• a: 8.2985 ± 0.0003 Å
• b: 12.4067 ± 0.0005 Å
• c: 15.4189 ± 0.0006 Å
• α: 112.63 ± 0.004°
• β: 94.271 ± 0.003°
• γ: 94.603 ± 0.003°
• Cell volume: 1450.93 ± 0.11 ų
• Cell temperature: 133 ± 2 K
• Ambient diffraction temperature: 133 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0453
• Residual factor for significantly intense reflections: 0.0267
• Weighted residual factors for significantly intense reflections: 0.0406
• Weighted residual factors for all reflections included in the refinement: 0.0419
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No