Information card for entry 2003476

Structure parameters

• Formula: C28 H22 F6 N2 Ni O4 S2
• Calculated formula: C27 H21 F6 N2 Ni O4 S3
• Title of publication: Bis(3-methylpyridine)bis[4,4,4-trifluoro-1-(2-thienyl)-1,3-butanedionato]nickel(II)
• Authors of publication: Xiong, R.-G.; You, X.-Z.; Dong, J.-X.; Huang, X.-Y.
• Journal of publication: Acta Crystallographica Section C
• Year of publication: 1995
• Journal volume: 51
• Journal issue: 5
• Pages of publication: 835 - 837
• a: 10.32 ± 0.008 Å
• b: 16.094 ± 0.007 Å
• c: 9.546 ± 0.004 Å
• α: 105.3 ± 0.04°
• β: 91.66 ± 0.05°
• γ: 83.68 ± 0.05°
• Cell volume: 1520 ± 1.5 ų
• Cell temperature: 296 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.058
• Weighted residual factors for significantly intense reflections: 0.068
• Goodness-of-fit parameter for significantly intense reflections: 1.53
• Diffraction radiation wavelength: 0.71069 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No