Information card for entry 7204000

Structure parameters

• Formula: C52 H27 Co N11
• Calculated formula: C52 H24 Co N11
• Title of publication: Multi-dimensional π‒π stacking interaction in neutral radical crystals obtained by electrochemical oxidation of [CoIII(2,3-Nc)(CN)2]− (2,3-Nc = 2,3-naphthalocyanine)
• Authors of publication: Matsumura, Naoko; Fujita, Akiko; Naito, Toshio; Inabe, Tamotsu
• Journal of publication: Journal of Materials Chemistry
• Year of publication: 2000
• Journal volume: 10
• Journal issue: 10
• Pages of publication: 2266
• a: 9.864 ± 0.002 Å
• b: 12.475 ± 0.004 Å
• c: 8.827 ± 0.002 Å
• α: 107.83 ± 0.02°
• β: 93.02 ± 0.02°
• γ: 102.3 ± 0.02°
• Cell volume: 1002.1 ± 0.5 ų
• Cell temperature: 296.2 K
• Number of distinct elements: 4
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for significantly intense reflections: 0.0724
• Weighted residual factors for all reflections included in the refinement: 0.08
• Goodness-of-fit parameter for all reflections included in the refinement: 3.44
• Diffraction radiation wavelength: 0.7107 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No