Information card for entry 4081717

Structure parameters

• Formula: C38 H34 B Cl P2 Sn
• Calculated formula: C38 H34 B Cl P2 Sn
• SMILES: [Sn]1(Cl)[P](C[B](C[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1
• Title of publication: Synthesis of Zwitterionic Group 14 Centered Complexes: Traditional Coordination and Unusual Insertion Chemistry
• Authors of publication: Weicker, Sarah A.; Dube, Jonathan W.; Ragogna, Paul J.
• Journal of publication: Organometallics
• Year of publication: 2013
• Journal volume: 32
• Journal issue: 22
• Pages of publication: 6681
• a: 33.107 ± 0.005 Å
• b: 33.107 ± 0.005 Å
• c: 17.609 ± 0.004 Å
• α: 90°
• β: 90°
• γ: 120°
• Cell volume: 16715 ± 5 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 6
• Space group number: 148
• Hermann-Mauguin space group symbol: R -3 :H
• Hall space group symbol: -R 3
• Residual factor for all reflections: 0.0915
• Residual factor for significantly intense reflections: 0.0496
• Weighted residual factors for significantly intense reflections: 0.1249
• Weighted residual factors for all reflections included in the refinement: 0.1432
• 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: Yes
• Has Fobs: No