Information card for entry 4079203

Structure parameters

• Common name: [N{(C3F7)C(2-(CF3)C6H3)N}2]Cu(C2H4)
• Formula: C24 H12 Cu F20 N3
• Calculated formula: C24 H12 Cu F20 N3
• SMILES: C1(=[N](c2ccccc2C(F)(F)F)[Cu]2(N(C(=N1)C(C(C(F)(F)F)(F)F)(F)F)c1c(cccc1)C(F)(F)F)[CH2]=[CH2]2)C(C(C(F)(F)F)(F)F)(F)F
• Title of publication: Copper(I) Ethylene Complexes Supported by 1,3,5-Triazapentadienyl Ligands with Electron-Withdrawing Groups
• Authors of publication: Adiraju, Venkata A.K.; Flores, Jaime A.; Yousufuddin, Muhammed; Dias, H. V. Rasika
• Journal of publication: Organometallics
• Year of publication: 2012
• Journal volume: 31
• Journal issue: 22
• Pages of publication: 7926
• a: 7.532 ± 0.0004 Å
• b: 22.7008 ± 0.0011 Å
• c: 8.7206 ± 0.0004 Å
• α: 90°
• β: 105.393 ± 0.001°
• γ: 90°
• Cell volume: 1437.58 ± 0.12 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 11
• Hermann-Mauguin space group symbol: P 1 21/m 1
• Hall space group symbol: -P 2yb
• Residual factor for all reflections: 0.043
• Residual factor for significantly intense reflections: 0.0418
• Weighted residual factors for significantly intense reflections: 0.1155
• Weighted residual factors for all reflections included in the refinement: 0.118
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No