Information card for entry 7105796

Structure parameters

• Common name: H3CMn(CO)3(CNArDipp2)2
• Formula: C132 H154 Mn2 N4 O6
• Calculated formula: C132 H154 Mn2 N4 O6
• Title of publication: Electrophilic functionalization of well-behaved manganese monoanions supported by m-terphenyl isocyanides
• Authors of publication: Mason Stewart; Curtis Moore; Treffly Ditri; Liezel Labios; Arnold Rheingold; Joshua Figueroa
• Journal of publication: Chem.Commun.
• Year of publication: 2011
• Journal volume: 47
• Pages of publication: 406
• a: 16.737 ± 0.006 Å
• b: 18.896 ± 0.008 Å
• c: 20.57 ± 0.008 Å
• α: 114.849 ± 0.005°
• β: 90.031 ± 0.005°
• γ: 90.131 ± 0.005°
• Cell volume: 5903 ± 4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 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: 0.0737
• Residual factor for significantly intense reflections: 0.0488
• Weighted residual factors for significantly intense reflections: 0.12
• Weighted residual factors for all reflections included in the refinement: 0.1297
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No