Information card for entry 7060861

Structure parameters

• Formula: C14 H18 N2 O
• Calculated formula: C14 H18.25 N2 O
• SMILES: O=C1NC2(Nc3c1cccc3)CCC(CC2)C
• Title of publication: Probing the catalytic activity of highly efficient sulfonic acid fabricated cobalt ferrite magnetic nanoparticles for the clean and scalable synthesis of dihydro, spiro and bis quinazolinones
• Authors of publication: Yadav, Priyanka; Awasthi, Satish K.
• Journal of publication: New Journal of Chemistry
• Year of publication: 2021
• Journal volume: 45
• Journal issue: 35
• Pages of publication: 15928 - 15941
• a: 10.223 ± 0.008 Å
• b: 11.333 ± 0.012 Å
• c: 21.64 ± 0.02 Å
• α: 90°
• β: 90°
• γ: 90°
• Cell volume: 2507 ± 4 ų
• Ambient diffraction temperature: 119.98 K
• Number of distinct elements: 4
• Space group number: 1
• Hermann-Mauguin space group symbol: P 1
• Hall space group symbol: P 1
• Residual factor for all reflections: 0.2422
• Residual factor for significantly intense reflections: 0.1484
• Weighted residual factors for significantly intense reflections: 0.3604
• Weighted residual factors for all reflections included in the refinement: 0.4592
• Goodness-of-fit parameter for all reflections included in the refinement: 1.3427
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No