Information card for entry 7008071

Structure parameters

• Formula: C56 H70 Cl6 P2 Pt
• Calculated formula: C56 H70 Cl6 P2 Pt
• SMILES: c1(ccccc1C(C)C)[P](c1ccccc1C(C)C)([Pt]([P](c1ccccc1C(C)C)(c1ccccc1C(C)C)c1ccccc1C(C)C)(Cl)Cl)c1ccccc1C(C)C.C(Cl)Cl.C(Cl)Cl
• Title of publication: Special effects of ortho-isopropylphenyl groups. Diastereoisomerism in platinum(II) and palladium(II) complexes of helically chiral PAr3 ligands.
• Authors of publication: Baber, R. Angharad; Orpen, A. Guy; Pringle, Paul G.; Wilkinson, Matthew J.; Wingad, Richard L.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2005
• Journal issue: 4
• Pages of publication: 659 - 667
• a: 9.6403 ± 0.0019 Å
• b: 11.055 ± 0.002 Å
• c: 14.148 ± 0.003 Å
• α: 97.94 ± 0.03°
• β: 95.31 ± 0.03°
• γ: 113.82 ± 0.03°
• Cell volume: 1347.7 ± 0.6 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 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: 0.0343
• Residual factor for significantly intense reflections: 0.0338
• Weighted residual factors for significantly intense reflections: 0.0772
• Weighted residual factors for all reflections included in the refinement: 0.0774
• Goodness-of-fit parameter for all reflections included in the refinement: 1.018
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No