Information card for entry 7200514

Structure parameters

• Formula: C40 H40 Cl2 O5 P2 Pt S2
• Calculated formula: C36 H30 Cl2 O4 P2 Pt S2
• Title of publication: Synthesis and characterization of monomeric and polymeric Pd(II) and Pt(II) complexes of 3,4-ethylenedioxythiophene-functionalized phosphine ligands
• Authors of publication: Velauthamurty, Kuhamoorthy; Higgins, Simon J.; Rajapakse, R. M. Gamini; Bacsa, John; van Zalinge, Harm; Nichols, Richard J.; Haiss, Wolfgang
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2009
• Journal volume: 19
• Journal issue: 13
• Pages of publication: 1850
• a: 11.379 ± 0.002 Å
• b: 12.109 ± 0.002 Å
• c: 15.524 ± 0.003 Å
• α: 72.37 ± 0.004°
• β: 89.055 ± 0.005°
• γ: 66.038 ± 0.005°
• Cell volume: 1848.9 ± 0.6 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 ± 2 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 all reflections: 0.0623
• Residual factor for significantly intense reflections: 0.0403
• Weighted residual factors for significantly intense reflections: 0.0901
• Weighted residual factors for all reflections included in the refinement: 0.0955
• Goodness-of-fit parameter for all reflections included in the refinement: 0.916
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No