Information card for entry 4343082

Structure parameters

• Formula: C28 H25 B2 F12 N2 O3 Sb
• Calculated formula: C28 H25 B2 F12 N2 O3 Sb
• SMILES: [Sb]12(OB(OB(O1)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1cc(cc(c1)C(F)(F)F)C(F)(F)F)c1c(C[N]2(C)C)cccc1CN(C)C
• Title of publication: From Stiba- and Bismaheteroboroxines to N,C,N-Chelated Diorganoantimony(III) and Bismuth(III) Cations-An Unexpected Case of Aryl Group Migration.
• Authors of publication: Dostál, Libor; Jambor, Roman; Růžička, Aleš; Jirásko, Robert; Lyčka, Antonín; Beckmann, Jens; Ketkov, Sergey
• Journal of publication: Inorganic chemistry
• Year of publication: 2015
• Journal volume: 54
• Journal issue: 12
• Pages of publication: 6010 - 6019
• a: 9.4649 ± 0.0006 Å
• b: 12.8452 ± 0.0009 Å
• c: 14.538 ± 0.0008 Å
• α: 65.607 ± 0.004°
• β: 88.877 ± 0.006°
• γ: 82.897 ± 0.006°
• Cell volume: 1596.41 ± 0.18 ų
• Cell temperature: 150 ± 1 K
• Ambient diffraction temperature: 150 ± 1 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: 0.0314
• Residual factor for significantly intense reflections: 0.0289
• Weighted residual factors for significantly intense reflections: 0.0724
• Weighted residual factors for all reflections included in the refinement: 0.0747
• Goodness-of-fit parameter for all reflections included in the refinement: 1.227
• Diffraction radiation wavelength: 0.71073 Å
• Diffraction radiation type: MoKα
• Has coordinates: Yes
• Has disorder: No
• Has Fobs: No