Information card for entry 7024478

Structure parameters

• Formula: C47 H109 Mo2 O7 Zn6
• Calculated formula: C47 H109 Mo2 O7 Zn6
• Title of publication: Activation of C-H bonds mediated by Mo[triple bond]Mo moieties in heterobimetallic Zn/O/Mo clusters.
• Authors of publication: Ma, Jian-Gong; Aksu, Yilmaz; Gregoriades, Laurence J.; Sauer, Joachim; Driess, Matthias
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 1
• Pages of publication: 103 - 106
• a: 11.6661 ± 0.0005 Å
• b: 15.6084 ± 0.0005 Å
• c: 18.587 ± 0.0008 Å
• α: 110.492 ± 0.004°
• β: 99.111 ± 0.004°
• γ: 90.256 ± 0.003°
• Cell volume: 3123.8 ± 0.2 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 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: 0.0954
• Residual factor for significantly intense reflections: 0.0429
• Weighted residual factors for significantly intense reflections: 0.0833
• Weighted residual factors for all reflections included in the refinement: 0.0904
• Goodness-of-fit parameter for all reflections included in the refinement: 0.881
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No