Information card for entry 7026704

Structure parameters

• Formula: C40 H52 B2 Cu2 F8 N6 O6
• Calculated formula: C40 H52 B2 Cu2 F8 N6 O6
• Title of publication: Synthesis and characterization of aryl substituted bis(2-pyridyl)amines and their copper olefin complexes: investigation of remote steric control over olefin binding.
• Authors of publication: Allen, John J.; Hamilton, Christopher E.; Barron, Andrew R.
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2010
• Journal volume: 39
• Journal issue: 47
• Pages of publication: 11451 - 11468
• a: 12.762 ± 0.003 Å
• b: 7.7754 ± 0.0016 Å
• c: 23.501 ± 0.005 Å
• α: 90°
• β: 100.72 ± 0.03°
• γ: 90°
• Cell volume: 2291.3 ± 0.9 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Ambient diffracton pressure: 101.33 kPa
• Number of distinct elements: 7
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1096
• Residual factor for significantly intense reflections: 0.052
• Weighted residual factors for significantly intense reflections: 0.1118
• Weighted residual factors for all reflections included in the refinement: 0.1367
• Goodness-of-fit parameter for all reflections included in the refinement: 1.013
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No