Information card for entry 4349284

Structure parameters

• Common name: IMn(CO)3(CNArDipp2)2(C4H8O)
• Formula: C73 H90 I Mn N2 O5
• Calculated formula: C73 H90 I Mn N2 O5
• 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: 16.7392 ± 0.0014 Å
• b: 17.0282 ± 0.0014 Å
• c: 24.298 ± 0.002 Å
• α: 90°
• β: 102.184 ± 0.003°
• γ: 90°
• Cell volume: 6769.9 ± 1 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• 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: 0.0912
• Residual factor for significantly intense reflections: 0.0577
• Weighted residual factors for significantly intense reflections: 0.1346
• Weighted residual factors for all reflections included in the refinement: 0.1491
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No