Information card for entry 7159230

Structure parameters

• Formula: C26 H26 N4 O5
• Calculated formula: C24 H20 N4 O4
• Title of publication: A potent fluorescent transmembrane HCl transporter perturbs cellular pH and promotes cancer cell death.
• Authors of publication: Fares, Mohamed; Wu, Xin; McNaughton, Daniel A.; Gilchrist, Alexander M.; Lewis, William; Keller, Paul A.; Arias-Betancur, Alain; Fontova, Pere; Pérez-Tomás, Ricardo; Gale, Philip A.
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2023
• Journal volume: 21
• Journal issue: 12
• Pages of publication: 2509 - 2515
• a: 28.2772 ± 0.001 Å
• b: 11.1135 ± 0.0009 Å
• c: 7.9823 ± 0.0003 Å
• α: 90°
• β: 90.234 ± 0.004°
• γ: 90°
• Cell volume: 2508.5 ± 0.2 ų
• Cell temperature: 100 ± 2 K
• Ambient diffraction temperature: 100 ± 2 K
• Number of distinct elements: 4
• Space group number: 13
• Hermann-Mauguin space group symbol: P 1 2/c 1
• Hall space group symbol: -P 2yc
• Residual factor for all reflections: 0.1531
• Residual factor for significantly intense reflections: 0.0661
• Weighted residual factors for significantly intense reflections: 0.1579
• Weighted residual factors for all reflections included in the refinement: 0.2088
• Goodness-of-fit parameter for all reflections included in the refinement: 0.931
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 1.54184 Å
• Diffraction radiation type: CuKα
• Diffraction radiation X-ray symbol: K-L~2,3~
• Has coordinates: Yes
• Has disorder: Yes
• Has Fobs: No