Information card for entry 4324894

Structure parameters

• Formula: C105.8 H73.6 Cl5.6 Ir2 N4 O4 P2
• Calculated formula: C105.8 H71.6 Cl5.6 Ir2 N4 O4 P2
• Title of publication: Water Attack Umpolung Aromatic Systems To Release Hydrogen
• Authors of publication: Tsun-Ren Chen; Hsiu-Pen Lee; Jhy-Der Chen
• Journal of publication: Inorganic Chemistry
• Year of publication: 2011
• Journal volume: 50
• Pages of publication: 3645 - 3650
• a: 16.7294 ± 0.001 Å
• b: 16.9491 ± 0.0009 Å
• c: 18.1593 ± 0.001 Å
• α: 111.171 ± 0.001°
• β: 97.084 ± 0.001°
• γ: 107.611 ± 0.001°
• Cell volume: 4417 ± 0.4 ų
• Cell temperature: 297 ± 2 K
• Ambient diffraction temperature: 297 ± 2 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0397
• Residual factor for significantly intense reflections: 0.0304
• Weighted residual factors for significantly intense reflections: 0.0945
• Weighted residual factors for all reflections included in the refinement: 0.1013
• Goodness-of-fit parameter for all reflections included in the refinement: 0.977
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No