Information card for entry 7029601

Structure parameters

• Formula: C36 H26 Cl2 P2 Pt
• Calculated formula: C36 H26 Cl2 P2 Pt
• SMILES: c12ccccc1c1ccccc1[P]2(c1ccccc1)[Pt](Cl)(Cl)[P]1(c2ccccc2c2ccccc12)c1ccccc1
• Title of publication: Platinum(ii)-phosphole complexes: synthesis and evaluation as enyne cycloisomerisation catalysts.
• Authors of publication: Fourmy, Kévin; Mallet-Ladeira, Sonia; Dechy-Cabaret, Odile; Gouygou, Maryse
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 18
• Pages of publication: 6728 - 6734
• a: 8.9972 ± 0.0005 Å
• b: 20.6666 ± 0.0012 Å
• c: 16.4344 ± 0.0009 Å
• α: 90°
• β: 103.66 ± 0.002°
• γ: 90°
• Cell volume: 2969.4 ± 0.3 ų
• Cell temperature: 180 ± 2 K
• Ambient diffraction temperature: 180 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.02
• Residual factor for significantly intense reflections: 0.0158
• Weighted residual factors for significantly intense reflections: 0.0337
• Weighted residual factors for all reflections included in the refinement: 0.0349
• Goodness-of-fit parameter for all reflections included in the refinement: 1.042
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No