Information card for entry 7701120

Structure parameters

• Formula: C15 H7 F3 N2 O2
• Calculated formula: C15 H7 F3 N2 O2
• Title of publication: Synthesis of non-peripherally tetra-substituted copper(ii) phthalocyanines: characterization, optical and surface properties, fabrication and photo-electrical properties of a photosensitive diode.
• Authors of publication: Günsel, Armağan; Bilgiçli, Ahmet T; Pişkin, Hasan; Tüzün, Burak; Yarasir, M Nilüfer; Gündüz, Bayram
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2019
• Journal volume: 48
• Journal issue: 39
• Pages of publication: 14839 - 14852
• a: 7.9064 ± 0.0013 Å
• b: 8.1423 ± 0.0011 Å
• c: 11.5605 ± 0.0017 Å
• α: 98.881 ± 0.01°
• β: 106.291 ± 0.011°
• γ: 95.593 ± 0.013°
• Cell volume: 697.96 ± 0.19 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296.15 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: 0.1298
• Residual factor for significantly intense reflections: 0.071
• Weighted residual factors for significantly intense reflections: 0.1823
• Weighted residual factors for all reflections included in the refinement: 0.2198
• Goodness-of-fit parameter for all reflections included in the refinement: 1.051
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No