Information card for entry 7158294

Structure parameters

• Formula: C24 H40 N6 O12
• Calculated formula: C24 H40 N6 O12
• Title of publication: Hydrophilic and hydrophobic carboxamide pincers as anion hosts.
• Authors of publication: Lohrman, Jessica; Pramanik, Subhamay; Kaur, Sandeep; Telikepalli, Hanumaiah; Day, Victor W.; Bowman-James, Kristin
• Journal of publication: Organic & biomolecular chemistry
• Year of publication: 2021
• Journal volume: 19
• Journal issue: 39
• Pages of publication: 8516 - 8520
• a: 11.0587 ± 0.0019 Å
• b: 14.955 ± 0.003 Å
• c: 8.8548 ± 0.0015 Å
• α: 90°
• β: 101.133 ± 0.002°
• γ: 90°
• Cell volume: 1436.9 ± 0.5 ų
• Cell temperature: 228 ± 2 K
• Ambient diffraction temperature: 228 ± 2 K
• Number of distinct elements: 4
• 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: 0.1009
• Residual factor for significantly intense reflections: 0.0512
• Weighted residual factors for significantly intense reflections: 0.1084
• Weighted residual factors for all reflections included in the refinement: 0.1334
• Goodness-of-fit parameter for all reflections included in the refinement: 1.025
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No