Information card for entry 7043790

Structure parameters

• Formula: C12 H13 Cu F6 N2 O2 P
• Calculated formula: C12 H13 Cu F6 N2 O2 P
• Title of publication: pH-Dependent structural diversity of a 2-pyridinemethanol Cu complex and its relatively strong magnetic exchange coupling via hydrogen bonding.
• Authors of publication: Hamaguchi, Tomohiko; Nagata, Tomoko; Hayami, Shinya; Kawata, Satoshi; Ando, Isao
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2017
• a: 8.8221 ± 0.0002 Å
• b: 19.4655 ± 0.0004 Å
• c: 8.7295 ± 0.0002 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1499.09 ± 0.06 ų
• Cell temperature: 250 ± 2 K
• Ambient diffraction temperature: 250 ± 2 K
• Number of distinct elements: 7
• Space group number: 60
• Hermann-Mauguin space group symbol: P b c n
• Hall space group symbol: -P 2n 2ab
• Residual factor for all reflections: 0.0314
• Residual factor for significantly intense reflections: 0.0282
• Weighted residual factors for significantly intense reflections: 0.0759
• Weighted residual factors for all reflections included in the refinement: 0.0784
• Goodness-of-fit parameter for all reflections included in the refinement: 1.122
• Diffraction radiation wavelength: 0.71075 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No