Information card for entry 8103371

Structure parameters

• Formula: C43 H42 N3 O2.5 Ru
• Calculated formula: C43 H39 N3 O2.5 Ru
• Title of publication: Crystal structure of [(E)-2-(2-((2,6-dimethylphenylimino)-(phenyl)methyl)-h5-cyclopentadienylamino)-3H-phenoxazin- 3-one]-(h5-pentamethylcyclopentadienyl)ruthenium(II) — ethanol (1:0.5), Ru(C10H15)(C32H24N3O2) · 0.5C2H6O
• Authors of publication: Barbara Enk; Holger Kopacka; Benno Bildstein; Klaus Wurst
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2012
• Journal volume: 227
• Journal issue: 2
• Pages of publication: 217
• a: 7.9365 ± 0.0002 Å
• b: 10.1819 ± 0.0003 Å
• c: 23.2824 ± 0.0005 Å
• α: 86.036 ± 0.002°
• β: 88.575 ± 0.002°
• γ: 83.484 ± 0.002°
• Cell volume: 1864.52 ± 0.08 ų
• Cell temperature: 233 ± 2 K
• Ambient diffraction temperature: 233 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0417
• Residual factor for significantly intense reflections: 0.0339
• Weighted residual factors for significantly intense reflections: 0.0812
• Weighted residual factors for all reflections included in the refinement: 0.085
• Goodness-of-fit parameter for all reflections included in the refinement: 1.095
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No