Information card for entry 4347302

Structure parameters

• Formula: C39 H61 Fe N2 P
• Calculated formula: C39 H61 Fe N2 P
• Title of publication: Oxidatively Triggered Carbon-Carbon Bond Formation in Ene-amide Complexes.
• Authors of publication: Jacobs, Brian P.; Wolczanski, Peter T.; Lobkovsky, Emil B.
• Journal of publication: Inorganic chemistry
• Year of publication: 2016
• Journal volume: 55
• Journal issue: 9
• Pages of publication: 4223 - 4232
• a: 10.318 ± 0.0005 Å
• b: 18.3944 ± 0.001 Å
• c: 22.0796 ± 0.0011 Å
• α: 68.324 ± 0.003°
• β: 78.952 ± 0.003°
• γ: 86.63 ± 0.003°
• Cell volume: 3821.7 ± 0.3 ų
• Cell temperature: 223 ± 2 K
• Ambient diffraction temperature: 223 ± 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: 0.0863
• Residual factor for significantly intense reflections: 0.0443
• Weighted residual factors for significantly intense reflections: 0.095
• Weighted residual factors for all reflections included in the refinement: 0.1169
• Goodness-of-fit parameter for all reflections included in the refinement: 1.009
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No