Information card for entry 8103087

Structure parameters

• Formula: C30 H48 Ir2 N2 O12
• Calculated formula: C30 H48 Ir2 N2 O12
• Title of publication: Crystal structure of amminebis(acetylacetonato-κ2O,O')-(diacetylmethanido-κC)iridium(III), Ir(NH3)(C5H7O2)3
• Authors of publication: Qiao-Wen Chang; Chang-Yi Hu; Zai-Fu Pan; Jia-Lin Chen; Qing-Song Ye; Xi-Zhu Chen; Yao Yu; Wei-Ping Liu
• Journal of publication: Zeitschrift für Kristallographie - New Crystal Structures
• Year of publication: 2011
• Journal volume: 226
• Journal issue: 1
• Pages of publication: 87
• a: 7.9494 ± 0.001 Å
• b: 8.0955 ± 0.001 Å
• c: 16.143 ± 0.002 Å
• α: 89.888 ± 0.001°
• β: 78.378 ± 0.001°
• γ: 61.607 ± 0.001°
• Cell volume: 889.84 ± 0.19 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0554
• Residual factor for significantly intense reflections: 0.0453
• Weighted residual factors for significantly intense reflections: 0.1616
• Weighted residual factors for all reflections included in the refinement: 0.1851
• Goodness-of-fit parameter for all reflections included in the refinement: 1.297
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No