Information card for entry 4070858

Structure parameters

• Chemical name: tris-[ethynylphenyl-bis-(triethylphosphine)Platinum iodide]amine
• Formula: C60 H102 I3 N P6 Pt3
• Calculated formula: C60 H92 I3 N P6 Pt3
• SMILES: [Pt](I)([P](CC)(CC)CC)([P](CC)(CC)CC)C#Cc1ccc(N(c2ccc(C#C[Pt](I)([P](CC)(CC)CC)[P](CC)(CC)CC)cc2)c2ccc(cc2)C#C[Pt](I)([P](CC)(CC)CC)[P](CC)(CC)CC)cc1
• Title of publication: Self-Assembly of a Nanoscopic Prism via a New Organometallic Pt3Acceptor and Its Fluorescent Detection of Nitroaromatics
• Authors of publication: Ghosh, Sushobhan; Mukherjee, Partha Sarathi
• Journal of publication: Organometallics
• Year of publication: 2008
• Journal volume: 27
• Journal issue: 3
• Pages of publication: 316
• a: 16.944 ± 0.005 Å
• b: 17.295 ± 0.005 Å
• c: 25.961 ± 0.007 Å
• α: 90°
• β: 101.622 ± 0.007°
• γ: 90°
• Cell volume: 7452 ± 4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 6
• 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: 0.2053
• Residual factor for significantly intense reflections: 0.0701
• Weighted residual factors for significantly intense reflections: 0.145
• Weighted residual factors for all reflections included in the refinement: 0.1992
• Goodness-of-fit parameter for all reflections included in the refinement: 0.919
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No