Information card for entry 7246993

Structure parameters

• Formula: C32 H32 Cl N3 O3
• Calculated formula: C32 H32 Cl N3 O3
• Title of publication: Highly regioselective and diastereoselective synthesis of novel pyrazinoindolones <i>via</i> a base-mediated Ugi-<i>N</i>-alkylation sequence.
• Authors of publication: Tajik, Maryam; Shiri, Morteza; Hussain, Faiq H. S.; Lotfi Nosood, Yazdanbakhsh; Baeiszadeh, Behnaz; Amini, Zahra; Bikas, Rahman; Pyra, Anna
• Journal of publication: RSC advances
• Year of publication: 2023
• Journal volume: 13
• Journal issue: 25
• Pages of publication: 16963 - 16969
• a: 26.155 ± 0.009 Å
• b: 6.9777 ± 0.0018 Å
• c: 30.372 ± 0.014 Å
• α: 90°
• β: 100.04 ± 0.04°
• γ: 90°
• Cell volume: 5458 ± 4 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 5
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/n 1
• Hall space group symbol: -P 2yac
• Residual factor for all reflections: 0.1308
• Residual factor for significantly intense reflections: 0.0888
• Weighted residual factors for significantly intense reflections: 0.2463
• Weighted residual factors for all reflections included in the refinement: 0.278
• Goodness-of-fit parameter for all reflections included in the refinement: 1.057
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No