Abstract
In the title dye compound, C19H14BF7N2, the boron–dipyrromethene core lies on a crystallographic mirror plane which bisects the BF2 and pentafluorophenyl groups. The dihedral angle between the pentafluorophenyl ring and the tricyclic system is thus 90° by symmetry. The sp 3-hybridized B atom has a slightly distorted tetrahedral coordination.
Highlights
In the title dye compound, C19H14BF7N2, the boron– dipyrromethene core lies on a crystallographic mirror plane which bisects the BF2 and pentafluorophenyl groups
Supplementary data and figures for this paper are available from the IUCr electronic archives (Reference: BH2269)
Refinement on F2 Least-squares matrix: full R[F2 > 2σ(F2)] = 0.056 wR(F2) = 0.162 S = 1.06 1936 reflections 170 parameters 0 restraints 0 constraints Primary atom site location: structure-invariant direct methods
Summary
Key indicators: single-crystal X-ray study; T = 293 K; mean (C–C) = 0.004 A; R factor = 0.056; wR factor = 0.162; data-to-parameter ratio = 11.4. In the title dye compound, C19H14BF7N2, the boron– dipyrromethene core lies on a crystallographic mirror plane which bisects the BF2 and pentafluorophenyl groups. The dihedral angle between the pentafluorophenyl ring and the tricyclic system is 90 by symmetry. The sp3-hybridized B atom has a slightly distorted tetrahedral coordination. Related literature For boron–dipyrromethene (BODIPY) dyes, see: Bergstrom et al (2002); Trieflinger et al (2005). For geometrical parameters in other BODIPY-based compounds, see: Picou et al(1990); Wang et al(2007); Kuhn et al (1990)
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