Information card for entry 7017443

Structure parameters

• Common name: trans-Mo2(DAniF)2(OOCC6F5)2(CH2Cl2)
• Formula: C45 H32 Cl2 F10 Mo2 N4 O8
• Calculated formula: C45 H30 Cl2 F10 Mo2 N4 O8
• Title of publication: Supramolecular assemblies of dimolybdenum transoids built by Mo(2)-enhanced perfluorophenyl-perfluorophenyl synthons.
• Authors of publication: Han, Li Juan; Fan, Li Yan; Meng, Miao; Wang, Xuefeng; Liu, Chun Y.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2011
• Journal volume: 40
• Journal issue: 48
• Pages of publication: 12832 - 12838
• a: 22.421 ± 0.003 Å
• b: 12.2647 ± 0.0015 Å
• c: 17.654 ± 0.002 Å
• α: 90°
• β: 106.386 ± 0.001°
• γ: 90°
• Cell volume: 4657.4 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 7
• 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: 0.0348
• Residual factor for significantly intense reflections: 0.0289
• Weighted residual factors for significantly intense reflections: 0.0772
• Weighted residual factors for all reflections included in the refinement: 0.081
• Goodness-of-fit parameter for all reflections included in the refinement: 1.055
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No