Information card for entry 4079094

Structure parameters

• Common name: Complex_5
• Formula: C28.07 H24.07 B Cl0.14 N2 P Pd S2
• Calculated formula: C28.0675 H24.0675 B Cl0.135 N2 P Pd S2
• Title of publication: Utilizing the 8-Methoxycyclooct-4-en-1-ide Unit As a Hydrogen Atom Acceptor en Route to “Metal‒Borane Pincers”
• Authors of publication: Zech, Alexander; Haddow, Mairi F.; Othman, Hafiizah; Owen, Gareth R.
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 19
• Pages of publication: 6753
• a: 8.5363 ± 0.0002 Å
• b: 10.1753 ± 0.0003 Å
• c: 30.8938 ± 0.0009 Å
• α: 97.17 ± 0.001°
• β: 92.959 ± 0.002°
• γ: 98.336 ± 0.001°
• Cell volume: 2627.65 ± 0.13 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 8
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0439
• Residual factor for significantly intense reflections: 0.032
• Weighted residual factors for significantly intense reflections: 0.0684
• Weighted residual factors for all reflections included in the refinement: 0.0735
• Goodness-of-fit parameter for all reflections included in the refinement: 1.029
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No