Information card for entry 4107049

Structure parameters

• Formula: C28 H41 Cl3 F24 Ir2 N4 O10 P4
• Calculated formula: C28 H41 Cl3 F24 Ir2 N4 O10 P4
• Title of publication: Mechanistic Studies of O2 Reduction Effected by Group 9 Bimetallic Hydride Complexes
• Authors of publication: Thomas S. Teets; Daniel G. Nocera
• Journal of publication: Journal of the American Chemical Society
• Year of publication: 2011
• Journal volume: 133
• Pages of publication: 17796 - 17806
• a: 13.003 ± 0.002 Å
• b: 10.798 ± 0.002 Å
• c: 18.699 ± 0.004 Å
• α: 90°
• β: 91.086 ± 0.003°
• γ: 90°
• Cell volume: 2625 ± 0.8 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0645
• Residual factor for significantly intense reflections: 0.0493
• Weighted residual factors for significantly intense reflections: 0.1175
• Weighted residual factors for all reflections included in the refinement: 0.1216
• Goodness-of-fit parameter for all reflections included in the refinement: 1.079
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No