Information card for entry 4349283

Structure parameters

• Common name: Mn2(CO)7(CNArDipp2)3
• Formula: C100 H111 Mn2 N3 O7
• Calculated formula: C100 H111 Mn2 N3 O7
• Title of publication: Electrochemical Properties and CO₂-Reduction Ability of m-Terphenyl Isocyanide Supported Manganese Tricarbonyl Complexes.
• Authors of publication: Agnew, Douglas W.; Sampson, Matthew D.; Moore, Curtis E.; Rheingold, Arnold L.; Kubiak, Clifford P.; Figueroa, Joshua S.
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 23
• Pages of publication: 12400 - 12408
• a: 25.964 ± 0.003 Å
• b: 11.7576 ± 0.0013 Å
• c: 29.248 ± 0.004 Å
• α: 90°
• β: 90.045 ± 0.003°
• γ: 90°
• Cell volume: 8928.7 ± 1.9 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.1439
• Residual factor for significantly intense reflections: 0.1298
• Weighted residual factors for significantly intense reflections: 0.2854
• Weighted residual factors for all reflections included in the refinement: 0.2909
• Goodness-of-fit parameter for all reflections included in the refinement: 1.207
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No