Information card for entry 7247466

Structure parameters

• Formula: C23 H21 N3 O
• Calculated formula: C23 H21 N3 O
• SMILES: n1n(c2NC3=C(C(c4cc(ccc4)C)c2c1)C(=O)CCC3)c1ccccc1
• Title of publication: Microwave assisted one-pot access to pyrazolo quinolinone and tetrahydroisoxazolo quinolinone derivatives via T3P®-DMSO catalysed tandem oxidative–condensation reaction
• Authors of publication: Gowda, Darshini; Harsha, Kachigere B.; Shalini, Veeresha Gowda; Rangappa, Shobith; Rangappa, Kanchugarakoppal S.
• Journal of publication: RSC Advances
• Year of publication: 2023
• Journal volume: 13
• Journal issue: 40
• Pages of publication: 28362 - 28370
• a: 10.7713 ± 0.0016 Å
• b: 13.241 ± 0.0018 Å
• c: 13.3621 ± 0.0018 Å
• α: 90°
• β: 108.828 ± 0.005°
• γ: 90°
• Cell volume: 1803.8 ± 0.4 ų
• Cell temperature: 294 ± 2 K
• Ambient diffraction temperature: 294 ± 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: 0.0669
• Residual factor for significantly intense reflections: 0.0487
• Weighted residual factors for significantly intense reflections: 0.1237
• Weighted residual factors for all reflections included in the refinement: 0.1385
• Goodness-of-fit parameter for all reflections included in the refinement: 1.031
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No