Information card for entry 7028692

Structure parameters

• Formula: C33 H44 N2
• Calculated formula: C33 H44 N2
• SMILES: C(=N\c1c(cccc1C(C)C)C(C)C)(\c1cc(cc(c1)C)C)Nc1c(cccc1C(C)C)C(C)C
• Title of publication: Synthesis and characterisation of magnesium complexes containing sterically demanding N,N'-bis(aryl)amidinate ligands.
• Authors of publication: Moxey, Graeme J.; Ortu, Fabrizio; Goldney Sidley, Leon; Strandberg, Helen N.; Blake, Alexander J.; Lewis, William; Kays, Deborah L.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 12
• Pages of publication: 4838 - 4846
• a: 11.5654 ± 0.0006 Å
• b: 16.5227 ± 0.0008 Å
• c: 16.1572 ± 0.0009 Å
• α: 90°
• β: 109.525 ± 0.003°
• γ: 90°
• Cell volume: 2910 ± 0.3 ų
• Cell temperature: 90 ± 2 K
• Ambient diffraction temperature: 90 ± 2 K
• Number of distinct elements: 3
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1165
• Residual factor for significantly intense reflections: 0.0877
• Weighted residual factors for significantly intense reflections: 0.1695
• Weighted residual factors for all reflections included in the refinement: 0.1801
• Goodness-of-fit parameter for all reflections included in the refinement: 1.147
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No