Information card for entry 4339288

Structure parameters

• Formula: C158 H144 B2 Cl6 I2 Ir2 Mo2 N8 O6 P4
• Calculated formula: C158 H144 B2 Cl6 I2 Ir2 Mo2 N8 O6 P4
• Title of publication: Linear metal-metal-bonded tetranuclear M-Mo-Mo-M complexes (M = Ir and Rh): oxidative metal-metal bond formation in a tetrametallic system and 1,4-addition reaction of alkyl halides.
• Authors of publication: Ohashi, Masato; Shima, Asuka; Rüffer, Tobias; Mizomoto, Hitoshi; Kaneda, Yutaka; Mashima, Kazushi
• Journal of publication: Inorganic chemistry
• Year of publication: 2007
• Journal volume: 46
• Journal issue: 16
• Pages of publication: 6702 - 6714
• a: 33.885 ± 0.003 Å
• b: 19.787 ± 0.003 Å
• c: 27.629 ± 0.003 Å
• α: 90°
• β: 126.749 ± 0.004°
• γ: 90°
• Cell volume: 14843 ± 3 ų
• Cell temperature: 114 ± 1 K
• Ambient diffraction temperature: 114 ± 1 K
• Number of distinct elements: 10
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0999
• Residual factor for significantly intense reflections: 0.0586
• Weighted residual factors for significantly intense reflections: 0.1478
• Weighted residual factors for all reflections included in the refinement: 0.1691
• Goodness-of-fit parameter for all reflections included in the refinement: 1.03
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No