Information card for entry 7005794

Structure parameters

• Formula: C31 H57 B20 Ir3 O Se4
• Calculated formula: C28.9 H54.6 B20 Ir3 O Se4
• Title of publication: Construction of trinuclear iridium clusters through ancillary ortho-carborane-1,2-diselenolato ligands, with simultaneous iridium-induced B-H activation.
• Authors of publication: Liu, Shuang; Wang, Jian-Qiang; Weng, Lin-Hong; Jin, Guo-Xin
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2007
• Journal issue: 34
• Pages of publication: 3792 - 3797
• a: 11.197 ± 0.004 Å
• b: 14.099 ± 0.005 Å
• c: 15.972 ± 0.006 Å
• α: 79.961 ± 0.005°
• β: 84.524 ± 0.006°
• γ: 78.704 ± 0.005°
• Cell volume: 2429.8 ± 1.5 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0932
• Residual factor for significantly intense reflections: 0.0525
• Weighted residual factors for significantly intense reflections: 0.1162
• Weighted residual factors for all reflections included in the refinement: 0.1367
• Goodness-of-fit parameter for all reflections included in the refinement: 1.007
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No