Information card for entry 4087560

Structure parameters

• Formula: C19.86 H38 Br1.14 N0.86 O2 P2 Pt
• Calculated formula: C19.86 H38 Br1.14 N0.86 O2 P2 Pt
• SMILES: [Pt](Br)([P](CC)(CC)CC)(O)(c1c(OC)cccc1)([P](CC)(CC)CC)C#N.[Pt](Br)([P](CC)(CC)CC)(O)(c1c(OC)cccc1)([P](CC)(CC)CC)C#N.[Pt](Br)([P](CC)(CC)CC)(O)(c1c(OC)cccc1)([P](CC)(CC)CC)C#N.[Pt](Br)([P](CC)(CC)CC)(O)(c1c(OC)cccc1)([P](CC)(CC)CC)C#N.[Pt](Br)([P](CC)(CC)CC)(O)(c1c(OC)cccc1)([P](CC)(CC)CC)C#N.[Pt](Br)([P](CC)(CC)CC)(O)(c1c(OC)cccc1)([P](CC)(CC)CC)C#N.[Pt](Br)([P](CC)(CC)CC)(O)(c1c(OC)cccc1)(Br)[P](CC)(CC)CC
• Title of publication: Hydroxyl Radical Control through Hydrogen Bonding: Photolysis of Platinum(IV)hydroxido Complexes with Intramolecular H-Bonding
• Authors of publication: Wickramasinghe, Lasantha A.; Sharp, Paul R.
• Journal of publication: Organometallics
• Year of publication: 2015
• Journal volume: 34
• Journal issue: 14
• Pages of publication: 3451
• a: 12.637 ± 0.002 Å
• b: 16.421 ± 0.003 Å
• c: 12.161 ± 0.002 Å
• α: 90°
• β: 107.261 ± 0.002°
• γ: 90°
• Cell volume: 2409.9 ± 0.7 ų
• Cell temperature: 173 ± 2 K
• Ambient diffraction temperature: 173 ± 2 K
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0318
• Residual factor for significantly intense reflections: 0.0246
• Weighted residual factors for significantly intense reflections: 0.0533
• Weighted residual factors for all reflections included in the refinement: 0.0559
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No