Information card for entry 1572298

Structure parameters

• Formula: C20 H29 N3 O4 S
• Calculated formula: C20 H29 N3 O4 S
• Title of publication: Synthesis, Characterization, and Analysis of Probenecid and Pyridine Compound Salts
• Authors of publication: Zhang, Menglong; Hou, Xinyu; Yu, Fuhai; Zhang, Liang; Hou, Baohong; Zhou, Lina; Xie, Chuang; Wu, Songgu; Chen, Wei
• Journal of publication: Crystals
• Year of publication: 2024
• Journal volume: 14
• Journal issue: 7
• Pages of publication: 670
• a: 6.883 ± 0.0001 Å
• b: 7.1512 ± 0.0002 Å
• c: 43.1607 ± 0.0008 Å
• α: 90°
• β: 93.68 ± 0.002°
• γ: 90°
• Cell volume: 2120.06 ± 0.08 ų
• Cell temperature: 293 ± 2 K
• Ambient diffraction temperature: 293 ± 2 K
• Number of distinct elements: 5
• Space group number: 14
• Hermann-Mauguin space group symbol: P 1 21/c 1
• Hall space group symbol: -P 2ybc
• Residual factor for all reflections: 0.0574
• Residual factor for significantly intense reflections: 0.0534
• Weighted residual factors for significantly intense reflections: 0.1464
• Weighted residual factors for all reflections included in the refinement: 0.1496
• Goodness-of-fit parameter for all reflections included in the refinement: 1.1
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No