Information card for entry 7008073

Structure parameters

• Formula: C60 H76 Cl2 O6 P2 Pt2
• Calculated formula: C60 H76 Cl2 O6 P2 Pt2
• SMILES: O(c1cc(c([P]2(c3c(C(C)([Pt]42[Cl][Pt]2([P](c5c(C2(C)C)cc(OC)cc5)(c2c(cc(OC)cc2)C(C)C)c2c(C(C)C)cc(OC)cc2)[Cl]4)C)cc(OC)cc3)c2c(cc(OC)cc2)C(C)C)cc1)C(C)C)C
• 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: 11.359 ± 0.003 Å
• b: 11.719 ± 0.003 Å
• c: 13.13 ± 0.006 Å
• α: 101.28 ± 0.03°
• β: 104.34 ± 0.02°
• γ: 112.02 ± 0.03°
• Cell volume: 1486.7 ± 1 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.1607
• Residual factor for significantly intense reflections: 0.0654
• Weighted residual factors for significantly intense reflections: 0.1166
• Weighted residual factors for all reflections included in the refinement: 0.1379
• Goodness-of-fit parameter for all reflections included in the refinement: 0.886
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No