Information card for entry 7705532

Structure parameters

• Formula: C24 H10 B F15 O2
• Calculated formula: C24 H10 B F15 O2
• SMILES: Fc1c(c(F)c(F)c(F)c1F)[B]([O]=C1OCCCCC1)(c1c(F)c(F)c(F)c(F)c1F)c1c(F)c(F)c(F)c(F)c1F
• Title of publication: Comparative bindings of lactones, lactide, and cyclic carbonates: experimental insights into the coordination step of polymerization.
• Authors of publication: Udomsasporn, Kwanchanok; Haesuwannakij, Setsiri; Piromjitpong, Parichat; Chumsaeng, Phongnarin; Phomphrai, Khamphee
• Journal of publication: Dalton transactions (Cambridge, England : 2003)
• Year of publication: 2020
• Journal volume: 49
• Journal issue: 41
• Pages of publication: 14378 - 14382
• a: 10.3019 ± 0.0006 Å
• b: 11.4706 ± 0.0007 Å
• c: 11.941 ± 0.0007 Å
• α: 92.148 ± 0.002°
• β: 103.691 ± 0.002°
• γ: 107.901 ± 0.002°
• Cell volume: 1295.29 ± 0.13 ų
• Cell temperature: 110 K
• Ambient diffraction temperature: 110 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: 0.0455
• Residual factor for significantly intense reflections: 0.0381
• Weighted residual factors for significantly intense reflections: 0.1046
• Weighted residual factors for all reflections included in the refinement: 0.1097
• Goodness-of-fit parameter for all reflections included in the refinement: 1.032
• Diffraction radiation probe: x-ray
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Diffraction radiation X-ray symbol: K-L~3~
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No