Information card for entry 4072796

Structure parameters

• Formula: C22 H35 Mg N2 P
• Calculated formula: C22 H35 Mg N2 P
• SMILES: [Mg]12([N](C(C)(C)C)=P(C2c2cccc3ccc[n]1c23)(C(C)C)C(C)C)CC
• Title of publication: Lithium, Magnesium, and Zinc Iminophosphorano(8-quinolyl)methanide Complexes: Syntheses, Characterization, and Activity in ε-Caprolactone Polymerization
• Authors of publication: Wang, Zhong-Xia; Qi, Chun-Yan
• Journal of publication: Organometallics
• Year of publication: 2007
• Journal volume: 26
• Journal issue: 9
• Pages of publication: 2243
• a: 7.951 ± 0.009 Å
• b: 9.184 ± 0.011 Å
• c: 16.791 ± 0.019 Å
• α: 95.46 ± 0.02°
• β: 91.68 ± 0.019°
• γ: 94.724 ± 0.019°
• Cell volume: 1216 ± 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: 0.0974
• Residual factor for significantly intense reflections: 0.0522
• Weighted residual factors for significantly intense reflections: 0.1221
• Weighted residual factors for all reflections included in the refinement: 0.1466
• Goodness-of-fit parameter for all reflections included in the refinement: 1.024
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No