Information card for entry 1551836

Structure parameters

• Formula: C39 H47 Cl Cs N7 O2
• Calculated formula: C39 H47 Cl Cs N7 O2
• Title of publication: Synthetic ion transporters can induce apoptosis by facilitating chloride anion transport into cells
• Authors of publication: Sung-Kyun Ko; Sung Kuk Kim; Andrew Share; Vincent M. Lynch; Jinhong Park; Wan Namkung; Wim Van Rossom; Nathalie Busschaert; Philip A. Gale; Jonathan L. Sessler; Injae Shin
• Journal of publication: Nature Chemistry
• Year of publication: 2014
• Journal volume: 6
• Pages of publication: 885 - 892
• a: 10.778 ± 0.0015 Å
• b: 16.187 ± 0.002 Å
• c: 10.773 ± 0.0014 Å
• α: 90°
• β: 103.801 ± 0.005°
• γ: 90°
• Cell volume: 1825.2 ± 0.4 ų
• Cell temperature: 153 ± 2 K
• Ambient diffraction temperature: 153 ± 2 K
• Number of distinct elements: 6
• Space group number: 4
• Hermann-Mauguin space group symbol: P 1 21 1
• Hall space group symbol: P 2yb
• Residual factor for all reflections: 0.0529
• Residual factor for significantly intense reflections: 0.041
• Weighted residual factors for significantly intense reflections: 0.0797
• Weighted residual factors for all reflections included in the refinement: 0.0837
• Goodness-of-fit parameter for all reflections included in the refinement: 1.028
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No