Information card for entry 7040768

Structure parameters

• Formula: C41 H59 K Mn N3 O11
• Calculated formula: C41 H59 K Mn N3 O11
• Title of publication: Electrocatalytic reduction of carbon dioxide with Mn(terpyridine) carbonyl complexes.
• Authors of publication: Machan, Charles W.; Kubiak, Clifford P.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2016
• Journal volume: 45
• Journal issue: 43
• Pages of publication: 17179 - 17186
• a: 9.3458 ± 0.0008 Å
• b: 9.7583 ± 0.0009 Å
• c: 23.585 ± 0.002 Å
• α: 78.713 ± 0.004°
• β: 86.471 ± 0.004°
• γ: 85.761 ± 0.004°
• Cell volume: 2101.1 ± 0.3 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1099
• Residual factor for significantly intense reflections: 0.0705
• Weighted residual factors for significantly intense reflections: 0.1735
• Weighted residual factors for all reflections included in the refinement: 0.2036
• Goodness-of-fit parameter for all reflections included in the refinement: 1.0532
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No