Information card for entry 4337824

Structure parameters

• Formula: C54 H47 Cl3 F6 N4 O2 P3 Rh
• Calculated formula: C54 H47 Cl3 F6 N4 O2 P3 Rh
• SMILES: [Rh]12(Cl)([N](=CC(=[N]1N=C(c1ccccc1)O2)C)NC(=O)c1ccccc1)([P](c1ccccc1)(c1ccccc1)c1ccccc1)[P](c1ccccc1)(c1ccccc1)c1ccccc1.[P](F)(F)(F)(F)(F)[F-].C(Cl)Cl
• Title of publication: Ruthenium, Rhodium, Osmium, and Iridium Complexes of Osazones (Osazones = Bis-Arylhydrazones of Glyoxal): Radical versus Nonradical States.
• Authors of publication: Patra, Sarat Chandra; Weyhermüller, Thomas; Ghosh, Prasanta
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Journal volume: 53
• Journal issue: 5
• Pages of publication: 2427 - 2440
• a: 11.4399 ± 0.0015 Å
• b: 14.218 ± 0.002 Å
• c: 18.786 ± 0.004 Å
• α: 102.24 ± 0.003°
• β: 100.287 ± 0.003°
• γ: 113.189 ± 0.002°
• Cell volume: 2625.5 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0477
• Residual factor for significantly intense reflections: 0.0404
• Weighted residual factors for significantly intense reflections: 0.1081
• Weighted residual factors for all reflections included in the refinement: 0.1144
• Goodness-of-fit parameter for all reflections included in the refinement: 1.071
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No