Information card for entry 4309114

Structure parameters

• Formula: C25 H33 N Ni O6 S10
• Calculated formula: C25 H33 N Ni O6 S10
• Title of publication: Magnetism of [Ni(dmit)2] Salts with [Meso- and (1S, 2S)-Diphenyl-1,2-Ethanediammonium]([18]crown-6)2 Supramolecular Cations
• Authors of publication: Tomoyuki Akutagawa; Kazumasa Matsuura; Asako Hashimoto; Takayoshi Nakamura
• Journal of publication: Inorganic Chemistry
• Year of publication: 2005
• Journal volume: 44
• Pages of publication: 4454 - 4456
• a: 12.058 ± 0.002 Å
• b: 12.234 ± 0.002 Å
• c: 13.187 ± 0.002 Å
• α: 111.542 ± 0.003°
• β: 94.241 ± 0.005°
• γ: 103.08 ± 0.004°
• Cell volume: 1735.8 ± 0.5 ų
• Cell temperature: 93.1 K
• Number of distinct elements: 6
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.05
• Weighted residual factors for all reflections included in the refinement: 0.084
• Goodness-of-fit parameter for all reflections included in the refinement: 1.078
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No