Information card for entry 4334416

Structure parameters

• Formula: C22 H37 Br P2 Pt
• Calculated formula: C22 H37 Br P2 Pt
• SMILES: c1(cccc2ccccc12)[Pt]([P](CC)(CC)CC)(Br)[P](CC)(CC)CC
• Title of publication: High Quantum Yield Molecular Bromine Photoelimination from Mononuclear Platinum(IV) Complexes
• Authors of publication: Alice Raphael Karikachery; Han Baek Lee; Mehdi Masjedi; Andreas Ross; Morgan A. Moody; Xiaochen Cai; Megan Chui; Carl D. Hoff; Paul R. Sharp
• Journal of publication: Inorganic Chemistry
• Year of publication: 2013
• Journal volume: 52
• Pages of publication: 4113 - 4119
• a: 18.5761 ± 0.0017 Å
• b: 12.9695 ± 0.0012 Å
• c: 10.532 ± 0.001 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2537.4 ± 0.4 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 5
• Space group number: 62
• Hermann-Mauguin space group symbol: P n m a
• Hall space group symbol: -P 2ac 2n
• Residual factor for all reflections: 0.0712
• Residual factor for significantly intense reflections: 0.0514
• Weighted residual factors for significantly intense reflections: 0.118
• Weighted residual factors for all reflections included in the refinement: 0.1296
• Goodness-of-fit parameter for all reflections included in the refinement: 1.115
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No