Information card for entry 4309809

Structure parameters

• Formula: C46 H60 Mg2 N4 O6
• Calculated formula: C46 H60 Mg2 N4 O6
• SMILES: C1(=[N](c2ccccc2OC)[Mg]2(N(C(=C1)C)c1ccccc1OC)[O](C(C)(C)C)[Mg]1([N](=C(C=C(C)N1c1ccccc1OC)C)c1ccccc1OC)[O]2C(C)(C)C)C
• Title of publication: Comparative Study of the Coordination Chemistry and Lactide Polymerization of Alkoxide and Amide Complexes of Zinc and Magnesium with a β-Diiminato Ligand Bearing Ether Substituents
• Authors of publication: Malcolm H. Chisholm; Judith C. Gallucci; Khamphee Phomphrai
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 8004 - 8010
• a: 11.219 ± 0.001 Å
• b: 19.481 ± 0.003 Å
• c: 11.319 ± 0.001 Å
• α: 90°
• β: 109.44 ± 0.01°
• γ: 90°
• Cell volume: 2332.8 ± 0.5 ų
• Cell temperature: 200 ± 2 K
• Ambient diffraction temperature: 200 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0826
• Residual factor for significantly intense reflections: 0.0513
• Weighted residual factors for all reflections: 0.1457
• Weighted residual factors for all reflections included in the refinement: 0.1257
• Goodness-of-fit parameter for all reflections: 1.02
• Goodness-of-fit parameter for all reflections included in the refinement: 1.064
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No