Information card for entry 4069957

Structure parameters

• Formula: C64 H104 K2 Mg N4 O3 Si2
• Calculated formula: C64 H104 K2 Mg N4 O3 Si2
• SMILES: [Mg]12(N([Si](N1c1c(cccc1C(C)C)C(C)C)(C)C)c1c(cccc1C(C)C)C(C)C)N([Si](N2c1c(cccc1C(C)C)C(C)C)(C)C)c1c(cccc1C(C)C)C(C)C.[K]([O]1CCCC1)[O]1CCCC1.[K][O]1CCCC1
• Title of publication: Synthesis of Potassium−Magnesium Ate Complexes with a Bulky Diamido Ligand
• Authors of publication: Pi, Chengfu; Wan, Li; Gu, Yingying; Wu, Haoyu; Wang, Chengxi; Zheng, Wenjun; Weng, Linhong; Chen, Zhenxia; Yang, Xiaodian; Wu, Limin
• Journal of publication: Organometallics
• Year of publication: 2009
• Journal volume: 28
• Journal issue: 17
• Pages of publication: 5281
• a: 15.294 ± 0.003 Å
• b: 24.825 ± 0.006 Å
• c: 18.8 ± 0.004 Å
• α: 90°
• β: 112.095 ± 0.002°
• γ: 90°
• Cell volume: 6614 ± 2 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 7
• 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: 0.0671
• Residual factor for significantly intense reflections: 0.055
• Weighted residual factors for significantly intense reflections: 0.1446
• Weighted residual factors for all reflections included in the refinement: 0.1541
• Goodness-of-fit parameter for all reflections included in the refinement: 1.044
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No