Information card for entry 7033273

Structure parameters

• Formula: C34 H66 Mg2 N2 O6
• Calculated formula: C34 H66 Mg2 N2 O6
• SMILES: C1(=[O][Mg]2(OC(=C1)C(C)(C)C)[O](C(C)(C)CN(C)C)[Mg]1([O]=C(C=C(C(C)(C)C)O1)C(C)(C)C)[O]2C(CN(C)C)(C)C)C(C)(C)C
• Title of publication: New heteroleptic magnesium complexes for MgO thin film application.
• Authors of publication: Kim, Hyo-Suk; George, Sheby Mary; Park, Bo Keun; Son, Seung Uk; Kim, Chang Gyoun; Chung, Taek-Mo
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2015
• Journal volume: 44
• Journal issue: 5
• Pages of publication: 2103 - 2109
• a: 9.9012 ± 0.0003 Å
• b: 10.0337 ± 0.0004 Å
• c: 11.2703 ± 0.0004 Å
• α: 91.692 ± 0.002°
• β: 108.897 ± 0.002°
• γ: 108.191 ± 0.002°
• Cell volume: 995.68 ± 0.06 ų
• Cell temperature: 100 ± 1 K
• Ambient diffraction temperature: 100 ± 1 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: 0.0866
• Residual factor for significantly intense reflections: 0.0505
• Weighted residual factors for significantly intense reflections: 0.1143
• Weighted residual factors for all reflections included in the refinement: 0.1278
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No