Information card for entry 7011667

Structure parameters

• Formula: C34 H14 F24 N4 Ni2 O8
• Calculated formula: C34 H14 F24 N4 Ni2 O8
• Title of publication: Antiferromagnetic coupling of transition metal spins across pyrimidine and pyrazine bridges in dinuclear manganese(II), cobalt(II), nickel(II) and copper(II) 1,1,1,5,5,5-hexafluoropentane-2,4-dionate complexes
• Authors of publication: Takayuki Ishida; Takashi Kawakami; Shin-ichi Mitsubori; Takashi Nogami; Kizashi Yamaguchi; Hiizu Iwamura
• Journal of publication: J. Chem. Soc., Dalton Trans.
• Year of publication: 2002
• Journal issue: 16
• Pages of publication: 3177 - 3186
• a: 13.6123 ± 0.0007 Å
• b: 19.486 ± 0.001 Å
• c: 16.861 ± 0.001 Å
• α: 90°
• β: 98.962 ± 0.004°
• γ: 90°
• Cell volume: 4417.8 ± 0.4 ų
• Cell temperature: 220 K
• Number of distinct elements: 6
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for significantly intense reflections: 0.0618
• Weighted residual factors for all reflections included in the refinement: 0.1969
• Goodness-of-fit parameter for all reflections included in the refinement: 0.999
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No