Information card for entry 7020746

Structure parameters

• Formula: C32 H50 B F6 N3 O4 P2 Pt S2
• Calculated formula: C32 H50 B F6 N3 O4 P2 Pt S2
• SMILES: [Pt]12(B3N(c4c(N3C[P]1(C(C)(C)C)C(C)(C)C)cccc4)C[P]2(C(C)(C)C)C(C)(C)C)OS(=O)(=NS(=O)(=O)C(F)(F)F)C(F)(F)F.c1ccccc1
• Title of publication: Platinum complexes bearing a boron-based PBP pincer ligand: synthesis, structure, and application as a catalyst for hydrosilylation of 1-decene.
• Authors of publication: Ogawa, Hayato; Yamashita, Makoto
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2013
• Journal volume: 42
• Journal issue: 3
• Pages of publication: 625 - 629
• a: 12.497 ± 0.002 Å
• b: 22.313 ± 0.004 Å
• c: 14.664 ± 0.002 Å
• α: 90°
• β: 99.678 ± 0.002°
• γ: 90°
• Cell volume: 4030.8 ± 1.1 ų
• Cell temperature: 113.15 K
• Ambient diffraction temperature: 113 ± 2 K
• Number of distinct elements: 9
• 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: 0.0345
• Residual factor for significantly intense reflections: 0.0298
• Weighted residual factors for significantly intense reflections: 0.0848
• Weighted residual factors for all reflections included in the refinement: 0.0887
• Goodness-of-fit parameter for all reflections included in the refinement: 1.155
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No