Information card for entry 7028877

Structure parameters

• Formula: C35 H13 Cl2 Cu F6 N2 O4 Sb
• Calculated formula: C31 H36 Cl2 Cu F6 N2 O4 Sb
• SMILES: [Sb](F)(F)(F)(F)([F-])F.[Cu]123[N](c4c([N]3=Cc3c(O1)c(cc(OC)c3)C(C)(C)C)cccc4)=Cc1c(O2)c(cc(OC)c1)C(C)(C)C.ClCCl
• Title of publication: Characterization of one-electron oxidized copper(II)-salophen-type complexes; effects of electronic and geometrical structures on reactivities.
• Authors of publication: Asami, Kazutaka; Takashina, Akiko; Kobayashi, Misato; Iwatsuki, Satoshi; Yajima, Tatsuo; Kochem, Amélie; van Gastel, Maurice; Tani, Fumito; Kohzuma, Takamitsu; Thomas, Fabrice; Shimazaki, Yuichi
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2014
• Journal volume: 43
• Journal issue: 5
• Pages of publication: 2283 - 2293
• a: 10.8962 ± 0.0017 Å
• b: 12.008 ± 0.002 Å
• c: 13.632 ± 0.003 Å
• α: 89.71 ± 0.004°
• β: 81.617 ± 0.004°
• γ: 84.038 ± 0.004°
• Cell volume: 1754.9 ± 0.6 ų
• Cell temperature: 173 K
• Ambient diffraction temperature: 173 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 significantly intense reflections: 0.0857
• Weighted residual factors for all reflections included in the refinement: 0.2547
• Goodness-of-fit parameter for all reflections included in the refinement: 1.165
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No