Information card for entry 7708921

Structure parameters

• Formula: C36 H29 B F4 O P Sb
• Calculated formula: C36 H29 B F4 O P Sb
• SMILES: [Sb]1([O]=P(c2c1cccc2)(c1ccccc1)c1ccccc1)(c1ccccc1)(c1ccccc1)c1ccccc1.[B](F)(F)(F)[F-]
• Title of publication: Fluoride anion complexation and transport using a stibonium cation stabilized by an intramolecular PO → Sb pnictogen bond
• Authors of publication: Gonzalez, Vanessa M.; Park, Gyeongjin; Yang, Mengxi; Gabbaï, François P.
• Journal of publication: Dalton Transactions
• Year of publication: 2021
• a: 10.2656 ± 0.0007 Å
• b: 12.2123 ± 0.0009 Å
• c: 12.9782 ± 0.0009 Å
• α: 90.978 ± 0.002°
• β: 109.42 ± 0.002°
• γ: 92.554 ± 0.002°
• Cell volume: 1532.06 ± 0.19 ų
• Cell temperature: 110 K
• Ambient diffraction temperature: 110 K
• Number of distinct elements: 7
• Space group number: 2
• Hermann-Mauguin space group symbol: P -1
• Hall space group symbol: -P 1
• Residual factor for all reflections: 0.0295
• Residual factor for significantly intense reflections: 0.024
• Weighted residual factors for significantly intense reflections: 0.0506
• Weighted residual factors for all reflections included in the refinement: 0.0531
• Goodness-of-fit parameter for all reflections included in the refinement: 1.027
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No