Information card for entry 4067758

Structure parameters

• Formula: C35 H36 N2 O
• Calculated formula: C35 H36 N2 O
• Title of publication: Bis(2-alkylpyrrolidin-1-yl)methylidenes as Chiral Acyclic Diaminocarbene Ligands
• Authors of publication: Snead, David R.; Inagaki, Sebastien; Abboud, Khalil A.; Hong, Sukwon
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 7
• Pages of publication: 1729
• a: 16.0406 ± 0.0014 Å
• b: 10.8168 ± 0.0009 Å
• c: 56.512 ± 0.005 Å
• α: 90°
• β: 90.539 ± 0.001°
• γ: 90°
• Cell volume: 9804.8 ± 1.5 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 4
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.1757
• Residual factor for significantly intense reflections: 0.0555
• Weighted residual factors for significantly intense reflections: 0.0884
• Weighted residual factors for all reflections included in the refinement: 0.123
• Goodness-of-fit parameter for all reflections included in the refinement: 0.841
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No