Information card for entry 4300999

Structure parameters

• Formula: C272 H400 Cl6 P12 Pt6
• Calculated formula: C186 H272 Cl4 P8 Pt4
• Title of publication: A Platinum Acetylide Polymer with Sterically Demanding Substituents: Effect of Aggregation on the Triplet Excited State
• Authors of publication: Zhao, Xiaoming; Cardolaccia, Thomas; Farley, Richard T.; Abboud, Khalil A.; Schanze, Kirk S.
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Journal issue: 8
• Pages of publication: 2619 - 2627
• a: 11.9307 ± 0.0008 Å
• b: 24.2701 ± 0.0015 Å
• c: 32.747 ± 0.002 Å
• α: 72.186 ± 0.002°
• β: 89.427 ± 0.002°
• γ: 85.613 ± 0.002°
• Cell volume: 9000.2 ± 1 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: 0.0794
• Residual factor for significantly intense reflections: 0.058
• Weighted residual factors for significantly intense reflections: 0.1078
• Weighted residual factors for all reflections included in the refinement: 0.115
• Goodness-of-fit parameter for all reflections included in the refinement: 1.152
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No