Information card for entry 7026703

Structure parameters

• Chemical name: (dichloro)-di-(mu-chloro)-bis(N-Phenyl-N,N-(2,2-dipyridyl)amine)-dicopper(II)
• Formula: C32 H26 Cl4 Cu2 N6
• Calculated formula: C32 H26 Cl4 Cu2 N6
• SMILES: c12N(c3cccc[n]3[Cu]3([n]2cccc1)([Cl][Cu]1([n]2c(N(c4cccc[n]14)c1ccccc1)cccc2)([Cl]3)Cl)Cl)c1ccccc1
• 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: 16.282 ± 0.003 Å
• b: 7.3669 ± 0.0015 Å
• c: 27.085 ± 0.005 Å
• α: 90°
• β: 101.28 ± 0.03°
• γ: 90°
• Cell volume: 3186 ± 1.1 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 K
• Ambient diffracton pressure: 101.33 kPa
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for all reflections: 0.0425
• Residual factor for significantly intense reflections: 0.0286
• Weighted residual factors for significantly intense reflections: 0.0686
• Weighted residual factors for all reflections included in the refinement: 0.0747
• Goodness-of-fit parameter for all reflections included in the refinement: 1.048
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No