Information card for entry 4302564

Structure parameters

• Formula: C45 H75 Cl Co I N3 P3 Zr
• Calculated formula: C45 H75 Cl Co I N3 P3 Zr
• SMILES: I[Co]123[Zr](Cl)(N([P]1(C(C)C)C(C)C)c1c(cc(cc1C)C)C)(N([P]2(C(C)C)C(C)C)c1c(cc(cc1C)C)C)N([P]3(C(C)C)C(C)C)c1c(cc(cc1C)C)C
• Title of publication: Multielectron Redox Activity Facilitated by Metal-Metal Interactions in Early/Late Heterobimetallics: Co/Zr Complexes Supported by Phosphinoamide Ligands
• Authors of publication: Bennett P. Greenwood; Scott I. Forman; Gerard T. Rowe; Chun-Hsing Chen; Bruce M. Foxman; Christine M. Thomas
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 6251 - 6260
• a: 27.8496 ± 0.0008 Å
• b: 53.0394 ± 0.0014 Å
• c: 15.0536 ± 0.0004 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 22236.1 ± 1 ų
• Cell temperature: 120 K
• Ambient diffraction temperature: 120 K
• Number of distinct elements: 8
• Space group number: 43
• Hermann-Mauguin space group symbol: F d d 2
• Hall space group symbol: F 2 -2d
• Residual factor for all reflections: 0.038
• Residual factor for significantly intense reflections: 0.0332
• Weighted residual factors for all reflections: 0.0902
• Weighted residual factors for significantly intense reflections: 0.0867
• Weighted residual factors for all reflections included in the refinement: 0.0902
• Goodness-of-fit parameter for all reflections included in the refinement: 0.9936
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No