Information card for entry 7238544

Structure parameters

• Formula: C43 H36 Cl2 Co2 N8
• Calculated formula: C43 H36 Cl2 Co2 N8
• 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: 9.385 ± 0.0009 Å
• b: 13.304 ± 0.0012 Å
• c: 15.3654 ± 0.0011 Å
• α: 74.895 ± 0.007°
• β: 81.155 ± 0.007°
• γ: 75.541 ± 0.008°
• Cell volume: 1785.5 ± 0.3 ų
• Cell temperature: 100 K
• Ambient diffraction temperature: 100 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0967
• Residual factor for significantly intense reflections: 0.0833
• Weighted residual factors for all reflections: 0.0767
• Weighted residual factors for significantly intense reflections: 0.0728
• Weighted residual factors for all reflections included in the refinement: 0.0728
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1254
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No