Information card for entry 7249072

Structure parameters

• Chemical name: ANC-5
• Formula: C21 H19 F N6 O
• Calculated formula: C21 H19 F N6 O
• Title of publication: Design, synthesis, and anti-mycobacterial evaluation of 1,8-naphthyridine-3-carbonitrile analogues
• Authors of publication: Khetmalis, Yogesh Mahadu; Shobha, Singarapalle; Nandikolla, Adinarayana; Chandu, Ala; Murugesan, Sankaranarayanan; Kumar, Muthyala Murali Krishna; Chandra Sekhar, Kondapalli Venkata Gowri
• Journal of publication: RSC Advances
• Year of publication: 2024
• Journal volume: 14
• Journal issue: 31
• Pages of publication: 22676 - 22689
• a: 6.0338 ± 0.0001 Å
• b: 7.3549 ± 0.0002 Å
• c: 20.9236 ± 0.0005 Å
• α: 85.352 ± 0.002°
• β: 88.35 ± 0.002°
• γ: 73.647 ± 0.002°
• Cell volume: 888.04 ± 0.04 ų
• Cell temperature: 126 K
• Ambient diffraction temperature: 126 K
• Number of distinct elements: 5
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0496
• Residual factor for significantly intense reflections: 0.0461
• Weighted residual factors for significantly intense reflections: 0.1299
• Weighted residual factors for all reflections included in the refinement: 0.1328
• Goodness-of-fit parameter for all reflections included in the refinement: 1.093
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No