Information card for entry 4077489

Structure parameters

• Formula: C34 H44 N2
• Calculated formula: C34 H44 N2
• SMILES: c1(cc(ccc1)C(=N\c1c(cccc1C(C)C)C(C)C)\C)C(=N\c1c(cccc1C(C)C)C(C)C)\C
• Title of publication: Transition Metal Complexes with Sterically Demanding Ligands. 2.1Meisenheimer Complex Formation and Deprotonation Reactions of a Sterically Demanding Aromatic Diimine†
• Authors of publication: Nückel, Stefan; Burger, Peter
• Journal of publication: Organometallics
• Year of publication: 2000
• Journal volume: 19
• Journal issue: 17
• Pages of publication: 3305
• a: 16.319 ± 0.003 Å
• b: 49.65 ± 0.01 Å
• c: 7.487 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 6066.3 ± 1.8 ų
• Cell temperature: 183 ± 2 K
• Ambient diffraction temperature: 183 ± 2 K
• Number of distinct elements: 3
• Space group number: 43
• Hermann-Mauguin space group symbol: F d d 2
• Hall space group symbol: F 2 -2d
• Residual factor for all reflections: 0.0941
• Residual factor for significantly intense reflections: 0.0499
• Weighted residual factors for all reflections: 0.0909
• Weighted residual factors for significantly intense reflections: 0.0823
• Goodness-of-fit parameter for all reflections: 0.992
• Goodness-of-fit parameter for significantly intense reflections: 1.241
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No