Information card for entry 8105148

Structure parameters

• Formula: C19 H26 F6 I N2 P Ru
• Calculated formula: C19 H26 F6 I N2 P Ru
• SMILES: c12cccc[n]2[Ru]23456([c]7([cH]6[cH]5[c]4([cH]3[cH]27)C)C(C)C)([N](=C1)C(C)C)I.[P](F)(F)(F)(F)(F)[F-]
• Title of publication: Crystal structure of η6-p-cymene-iodido-(N-isopropyl-1-(pyridin-2-yl)methanimine-κ2 N,N′)ruthenium(II) hexafluorophosphate(V), C19H26IN2F6Ru
• Authors of publication: Gichumbi, Joel M.; Omondi, Bernard; Friedrich, Holger B.
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2020
• Journal volume: 235
• Journal issue: 2
• Pages of publication: 485 - 487
• a: 9.2401 ± 0.0002 Å
• b: 10.0187 ± 0.0003 Å
• c: 12.6892 ± 0.0003 Å
• α: 78.921 ± 0.001°
• β: 81.596 ± 0.001°
• γ: 83.654 ± 0.001°
• Cell volume: 1136.3 ± 0.05 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0195
• Residual factor for significantly intense reflections: 0.0174
• Weighted residual factors for significantly intense reflections: 0.0429
• Weighted residual factors for all reflections included in the refinement: 0.044
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No