Information card for entry 4067545

Structure parameters

• Chemical name: Mg{C(Me2pz)3}{N(SiMe3)2}
• Formula: C22 H39 Mg N7 Si2
• Calculated formula: C22 H39 Mg N7 Si2
• SMILES: [Mg]12([n]3n(c(cc3C)C)C(=n3n1c(cc3C)C)n1[n]2c(cc1C)C)N([Si](C)(C)C)[Si](C)(C)C
• Title of publication: Syntheses and Structural Diversity of Group 2 and Group 12 Tris(pyrazolyl)methaneand Zwitterionic Tris(pyrazolyl)methanideCompounds
• Authors of publication: Cushion, Michael G.; Meyer, Jens; Heath, Alex; Schwarz, Andrew D.; Fernández, Ignacio; Breher, Frank; Mountford, Philip
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 5
• Pages of publication: 1174
• a: 16.3849 ± 0.0002 Å
• b: 24.5357 ± 0.0004 Å
• c: 16.1402 ± 0.0002 Å
• α: 90°
• β: 119.546 ± 0.001°
• γ: 90°
• Cell volume: 5644.82 ± 0.15 ų
• Cell temperature: 150 K
• Ambient diffraction temperature: 150 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.0894
• Residual factor for significantly intense reflections: 0.0427
• Weighted residual factors for all reflections: 0.0597
• Weighted residual factors for significantly intense reflections: 0.0413
• Weighted residual factors for all reflections included in the refinement: 0.0413
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1122
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No