Information card for entry 7239325

Structure parameters

• Formula: C27 H20 N4 O2
• Calculated formula: C27 H20 N4 O2
• Title of publication: Copper oxide nanoparticle mediated ‘click chemistry’ for the synthesis of mono-, bis- and tris-triazole derivatives from 10,10-dipropargyl-9-anthrone as a key building block
• Authors of publication: Bagdi, Prasanta Ray; Basha, R. Sidick; Baruah, Pranjal Kumar; Khan, Abu T.
• Journal of publication: RSC Advances
• Year of publication: 2014
• Journal volume: 4
• Journal issue: 21
• Pages of publication: 10652
• a: 12.4688 ± 0.0007 Å
• b: 10.2492 ± 0.0006 Å
• c: 16.9379 ± 0.0009 Å
• α: 90°
• β: 97.094 ± 0.005°
• γ: 90°
• Cell volume: 2148 ± 0.2 ų
• Cell temperature: 296 ± 2 K
• Ambient diffraction temperature: 296 ± 2 K
• Number of distinct elements: 4
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/n 1
• Hall space group symbol: -P 2yn
• Residual factor for all reflections: 0.1181
• Residual factor for significantly intense reflections: 0.0634
• Weighted residual factors for significantly intense reflections: 0.1559
• Weighted residual factors for all reflections included in the refinement: 0.1991
• Goodness-of-fit parameter for all reflections included in the refinement: 1.021
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No