Information card for entry 7238546

Structure parameters

• Formula: C26 H18 N4 Ni
• Calculated formula: C26 H18 N4 Ni
• Title of publication: Planar Ni(ii), Cu(ii) and Co(ii) tetraaza[14]annulenes: structural, electronic and magnetic properties and application to field effect transistors
• Authors of publication: Whyte, Alexander M.; Shuku, Yoshiaki; Nichol, Gary S.; Matsushita, Michio M.; Awaga, Kunio; Robertson, Neil
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2012
• Journal volume: 22
• Journal issue: 34
• Pages of publication: 17967
• a: 20.428 ± 0.004 Å
• b: 12.905 ± 0.002 Å
• c: 6.973 ± 0.0012 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 1838.2 ± 0.6 ų
• Cell temperature: 150.1 K
• Ambient diffraction temperature: 150.1 K
• Number of distinct elements: 4
• Space group number: 36
• Hermann-Mauguin space group symbol: C m c 21
• Hall space group symbol: C 2c -2
• Residual factor for significantly intense reflections: 0.0377
• Weighted residual factors for all reflections included in the refinement: 0.0962
• Goodness-of-fit parameter for all reflections included in the refinement: 1.072
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No