Information card for entry 4081719

Structure parameters

• Formula: C51 H46 B P3 Sn
• Calculated formula: C51 H46 B P3 Sn
• SMILES: [Sn]1([P](C[B](C[P]1(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)(c1ccccc1)c1ccccc1)CP(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: 43.19 ± 0.02 Å
• b: 9.359 ± 0.005 Å
• c: 21.403 ± 0.01 Å
• α: 90°
• β: 94.947 ± 0.009°
• γ: 90°
• Cell volume: 8619 ± 7 ų
• Cell temperature: 150 ± 2 K
• Ambient diffraction temperature: 150 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.1977
• Residual factor for significantly intense reflections: 0.0735
• Weighted residual factors for significantly intense reflections: 0.1378
• Weighted residual factors for all reflections included in the refinement: 0.1806
• Goodness-of-fit parameter for all reflections included in the refinement: 0.962
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No