Information card for entry 7008221

Structure parameters

• Formula: C32 H54 B10 P4 Pt2
• Calculated formula: C32 H54 B10 P4 Pt2
• SMILES: [BH]1234[Pt]56([P](C)(C)c7ccccc7)([P](C)(C)c7ccccc7)[BH]789[BH]%10%115[BH]526[BH]263[BH]3%121[BH]18([BH]89%11[BH]%1052[BH]6318)[Pt]47%12([P](C)(C)c1ccccc1)[P](C)(C)c1ccccc1
• Title of publication: The capture of dioxygen, carbon monoxide and sulfur dioxide by [(PMe2Ph)4Pt2B10H10].
• Authors of publication: Bould, Jonathan; Kilner, Colin A.; Kennedy, John D.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2005
• Journal issue: 9
• Pages of publication: 1574 - 1582
• a: 17.164 ± 0.002 Å
• b: 11.3966 ± 0.0009 Å
• c: 20.0425 ± 0.0015 Å
• α: 90°
• β: 102.659 ± 0.002°
• γ: 90°
• Cell volume: 3825.2 ± 0.6 ų
• Cell temperature: 120 ± 2 K
• Ambient diffraction temperature: 120 ± 2 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: I 1 2/a 1
• Hall space group symbol: -I 2ya
• Residual factor for all reflections: 0.019
• Residual factor for significantly intense reflections: 0.0181
• Weighted residual factors for significantly intense reflections: 0.0462
• Weighted residual factors for all reflections included in the refinement: 0.0466
• Goodness-of-fit parameter for all reflections included in the refinement: 1.039
• Diffraction radiation wavelength: 0.6933 Å
• Diffraction radiation type: synchrotron
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No