Information card for entry 4320983

Structure parameters

• Formula: C15 H23 F12 N3 P2 Ru S3
• Calculated formula: C15 H23 F12 N3 P2 Ru S3
• Title of publication: Controlling Substitution Chemistry in Ruthenium(II) Systems. Synthesis of Heteroleptic Complexes Incorporating the [Ru([9]aneS3)]2+ Metal Center
• Authors of publication: Sue Roche; Harry Adams; Sharon E. Spey; James A. Thomas
• Journal of publication: Inorganic Chemistry
• Year of publication: 2000
• Journal volume: 39
• Pages of publication: 2385 - 2390
• a: 14.748 ± 0.005 Å
• b: 18.037 ± 0.007 Å
• c: 10.341 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2750.8 ± 1.8 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• Space group number: 33
• Hermann-Mauguin space group symbol: P n a 21
• Hall space group symbol: P 2c -2n
• Residual factor for all reflections: 0.0564
• Residual factor for significantly intense reflections: 0.0448
• Weighted residual factors for all reflections: 0.1292
• Weighted residual factors for significantly intense reflections: 0.1186
• Goodness-of-fit parameter for all reflections: 1.031
• Goodness-of-fit parameter for significantly intense reflections: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No