Information card for entry 4301193

Structure parameters

• Formula: C50 H56 Mg2 N4 O6
• Calculated formula: C50 H56 Mg2 N4 O6
• SMILES: c1(cc(ccc1C(=[N]1CC[N]2(C)C)c3ccccc3)OC)O[Mg]123[O](Cc1ccccc1)[Mg]12(Oc4cc(ccc4C(=[N]1CC[N]2(C)C)c1ccccc1)OC)[O]3Cc1ccccc1
• Title of publication: Preparation, Characterization, and Catalytic Studies of Magnesium Complexes Supported by NNO-Tridentate Schiff-Base Ligands
• Authors of publication: Wen-Chou Hung; Chu-Chieh Lin
• Journal of publication: Inorganic Chemistry
• Year of publication: 2009
• Journal volume: 48
• Pages of publication: 728 - 734
• a: 10.7266 ± 0.0012 Å
• b: 11.1226 ± 0.0012 Å
• c: 11.2529 ± 0.0013 Å
• α: 75.27 ± 0.002°
• β: 64.868 ± 0.002°
• γ: 85.752 ± 0.002°
• Cell volume: 1174.6 ± 0.2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0655
• Residual factor for significantly intense reflections: 0.0477
• Weighted residual factors for significantly intense reflections: 0.139
• Weighted residual factors for all reflections included in the refinement: 0.1537
• Goodness-of-fit parameter for all reflections included in the refinement: 1.038
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No