Information card for entry 7235390

Structure parameters

• Formula: C H F N O
• Calculated formula: C2.16667 H1.33333 F0.5 N1.5
• Title of publication: Synthesis of trifluoromethyl-substituted N-aryl-poly-1,2,3-triazole derivatives
• Authors of publication: Kumar, A. Sudheer; Kommu, Nagarjuna; Ghule, Vikas D.; Sahoo, Akhila K.
• Journal of publication: Journal of Materials Chemistry A
• Year of publication: 2014
• Journal volume: 2
• Journal issue: 21
• Pages of publication: 7917
• a: 18.596 ± 0.005 Å
• b: 10.898 ± 0.003 Å
• c: 28.644 ± 0.008 Å
• α: 90°
• β: 90.48 ± 0.004°
• γ: 90°
• Cell volume: 5805 ± 3 ų
• Cell temperature: 298 ± 2 K
• Ambient diffraction temperature: 298 ± 2 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 all reflections: 0.0814
• Residual factor for significantly intense reflections: 0.065
• Weighted residual factors for significantly intense reflections: 0.2038
• Weighted residual factors for all reflections included in the refinement: 0.2175
• Goodness-of-fit parameter for all reflections included in the refinement: 1.063
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No