Information card for entry 4341351

Structure parameters

• Formula: C23.5 H33.75 B2 Cl F8 N6 O0.19 Pd
• Calculated formula: C23.5 H33.434 B2 Cl F8 N6 O0.217 Pd
• Title of publication: Electrocatalytic Reduction of CO2 with Palladium Bis-N-heterocyclic Carbene Pincer Complexes.
• Authors of publication: Therrien, Jeffrey A.; Wolf, Michael O.; Patrick, Brian O.
• Journal of publication: Inorganic chemistry
• Year of publication: 2014
• Pages of publication: 141022083740000
• a: 8.3763 ± 0.0012 Å
• b: 11.8244 ± 0.0017 Å
• c: 16.462 ± 0.003 Å
• α: 76.396 ± 0.008°
• β: 85.371 ± 0.009°
• γ: 69.781 ± 0.008°
• Cell volume: 1487.1 ± 0.4 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: 0.0667
• Residual factor for significantly intense reflections: 0.0468
• Weighted residual factors for significantly intense reflections: 0.1012
• Weighted residual factors for all reflections included in the refinement: 0.111
• Goodness-of-fit parameter for all reflections included in the refinement: 1.034
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No