Information card for entry 2006464

Structure parameters

• Chemical name: {2,6-bis[(4R,5R)-1,3-dimethyl-4,5-diphenylimidazolidin- 2-yl]pyridine-N^1^,N,N^1^'}chloro-copper(II) hexafluorophosphate methanol solvate
• Formula: C39.5 H43 Cl Cu F6 N5 O0.5 P
• Calculated formula: C39.5 H43 Cl Cu F6 N5 O0.5 P
• Title of publication: A Copper(II) Complex of a New Chiral Tridentate Imidazoline Ligand
• Authors of publication: Bohnen, Frank M.; Goddard, Richard; Minidis, Alexander B. E.; Alexakis, Alexandre; Pfaltz, Andreas
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1997
• Journal volume: 53
• Journal issue: 9
• Pages of publication: 1236 - 1238
• a: 14.636 ± 0.002 Å
• b: 15.185 ± 0.003 Å
• c: 17.928 ± 0.002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 3984.5 ± 1.1 ų
• Cell temperature: 293 K
• Ambient diffraction temperature: 293 K
• Number of distinct elements: 8
• Space group number: 19
• Hermann-Mauguin space group symbol: P 21 21 21
• Hall space group symbol: P 2ac 2ab
• Residual factor for all reflections: 0.196
• Residual factor for significantly intense reflections: 0.059
• Weighted residual factors for significantly intense reflections: 0.139
• Weighted residual factors for all reflections included in the refinement: 0.179
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No