Information card for entry 4067246

Structure parameters

• Formula: C31 H41 Cl4 N3 O2 Pt2 S
• Calculated formula: C31 H41 Cl4 N3 O2 Pt2 S
• SMILES: [Pt]1(Cl)(Cl)([n]2c(cc(cc2C)C)C)[CH]2CN(S(=O)(=O)c3ccc(cc3)C)C[CH]3[Pt](Cl)(Cl)([n]4c(cc(cc4C)C)C)[CH]=3CC[CH]1=2
• Title of publication: A Unique Functional Group Transformation of Planar Chiral Diolefinic Organonitrogen Cycles Utilizing PtCl2(2,4,6-trimethylpyridine) Complexes
• Authors of publication: Tomooka, Katsuhiko; Shimada, Maki; Uehara, Kazuhiro; Ito, Masato
• Journal of publication: Organometallics
• Year of publication: 2010
• Journal volume: 29
• Journal issue: 24
• Pages of publication: 6632
• a: 7.657 ± 0.003 Å
• b: 13.343 ± 0.005 Å
• c: 18.092 ± 0.006 Å
• α: 102.958 ± 0.009°
• β: 98.22 ± 0.008°
• γ: 93.728 ± 0.008°
• Cell volume: 1773.8 ± 1.1 ų
• Cell temperature: 123 K
• Ambient diffraction temperature: 123 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0994
• Weighted residual factors for all reflections included in the refinement: 0.1725
• Goodness-of-fit parameter for all reflections included in the refinement: 1.118
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No