Information card for entry 4310500

Structure parameters

• Formula: C18 H26 N0.5 Ni0.5 S6
• Calculated formula: C18 H26 N0.5 Ni0.5 S6
• Title of publication: Syntheses, Structures, and Physical Properties of Nickel Bis(dithiolene) Complexes Containing Tetrathiafulvalene (TTF) Units
• Authors of publication: Emiko Fujiwara; Akiko Kobayashi; Hideki Fujiwara; Hayao Kobayashi
• Journal of publication: Inorganic Chemistry
• Year of publication: 2004
• Journal volume: 43
• Pages of publication: 1122 - 1129
• a: 29.018 ± 0.004 Å
• b: 8.5822 ± 0.0008 Å
• c: 19.133 ± 0.002 Å
• α: 90°
• β: 113.628 ± 0.005°
• γ: 90°
• Cell volume: 4365.4 ± 0.9 ų
• Cell temperature: 293.1 K
• Number of distinct elements: 5
• Space group number: 15
• Hermann-Mauguin space group symbol: C 1 2/c 1
• Hall space group symbol: -C 2yc
• Residual factor for significantly intense reflections: 0.0571
• Weighted residual factors for all reflections included in the refinement: 0.0574
• Goodness-of-fit parameter for all reflections included in the refinement: 1.412
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No