Information card for entry 4301190

Structure parameters

• Formula: C38 H46 Cl2 Mg2 N4 O4
• Calculated formula: C38 H46 Cl2 Mg2 N4 O4
• SMILES: [Mg]123(Oc4ccc(cc4C(=[N]2CC[N]3(C)C)C)Cl)[O]([Mg]23(Oc4ccc(cc4C(=[N]2CC[N]3(C)C)C)Cl)[O]1Cc1ccccc1)Cc1ccccc1
• 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: 21.998 ± 0.007 Å
• b: 10.641 ± 0.003 Å
• c: 17.614 ± 0.005 Å
• α: 90°
• β: 108.855 ± 0.006°
• γ: 90°
• Cell volume: 3902 ± 2 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Number of distinct elements: 6
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1139
• Residual factor for significantly intense reflections: 0.0491
• Weighted residual factors for significantly intense reflections: 0.1044
• Weighted residual factors for all reflections included in the refinement: 0.1239
• Goodness-of-fit parameter for all reflections included in the refinement: 1.005
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No