Information card for entry 4068157

Structure parameters

• Formula: C22 H30 F6 N4 P Rh
• Calculated formula: C22 H30 F6 N4 P Rh
• Title of publication: 1,10-Phenanthroline Analogue Pyridazine-Based N-Heterocyclic Carbene Ligands
• Authors of publication: Gierz, Verena; Maichle-Mössmer, Cäcilia; Kunz, Doris
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 2
• Pages of publication: 739
• a: 22.1049 ± 0.0011 Å
• b: 21.2338 ± 0.0014 Å
• c: 10.07 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 4726.6 ± 1 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 6
• Space group number: 56
• Hermann-Mauguin space group symbol: P c c n
• Hall space group symbol: -P 2ab 2ac
• Residual factor for all reflections: 0.1071
• Residual factor for significantly intense reflections: 0.0815
• Weighted residual factors for significantly intense reflections: 0.1391
• Weighted residual factors for all reflections included in the refinement: 0.1476
• Goodness-of-fit parameter for all reflections included in the refinement: 1.222
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No