Information card for entry 7013800

Structure parameters

• Formula: C26 H36 N2 O Zn
• Calculated formula: C26 H36 N2 O Zn
• SMILES: [Zn]1(N(C(=CC(=[N]1c1c(cccc1)OC)C)C)c1c(cccc1C(C)C)C(C)C)CC
• Title of publication: Magnesium and zinc complexes of a potentially tridentate beta-diketiminate ligand.
• Authors of publication: Dove, Andrew P.; Gibson, Vernon C.; Marshall, Edward L.; White, Andrew J. P.; Williams, David J.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2004
• Journal issue: 4
• Pages of publication: 570 - 578
• a: 11.6145 ± 0.0016 Å
• b: 16.025 ± 0.003 Å
• c: 13.905 ± 0.002 Å
• α: 90°
• β: 102.273 ± 0.012°
• γ: 90°
• Cell volume: 2528.9 ± 0.7 ų
• Cell temperature: 183 ± 2 K
• Ambient diffraction temperature: 183 ± 2 K
• Number of distinct elements: 5
• 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: 0.1057
• Residual factor for significantly intense reflections: 0.0541
• Weighted residual factors for significantly intense reflections: 0.1032
• Weighted residual factors for all reflections included in the refinement: 0.117
• Goodness-of-fit parameter for all reflections included in the refinement: 0.945
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No