Phenanthrene-9-carboxylic acid

Acta Crystallogr C. 1997 Sep 15:53 ( Pt 9):1265-7. doi: 10.1107/s0108270197005787.

Abstract

The title compound, C15H10O2, crystallized in the centrosymmetric space group C2/c. Hydrogen bonding is of the cyclic dimer type about a center of symmetry. The carboxyl H and O atoms are ordered. The phenanthrene core is almost planar and the dihedral angle between the core plane and the carboxyl group plane is only 1.8(1) degrees. The bay H atoms, H4 and H5, lie close to the core plane and 2.02 (2) A from each other; the refinement places them on opposite sides of the core plane, but this result has little statistical significance.

Publication types

  • Research Support, Non-U.S. Gov't
  • Research Support, U.S. Gov't, P.H.S.

MeSH terms

  • Carboxylic Acids / chemistry*
  • Crystallography, X-Ray*
  • Hydrogen Bonding
  • Models, Structural
  • Molecular Conformation
  • Phenanthrenes / chemistry*

Substances

  • Carboxylic Acids
  • Phenanthrenes
  • 9-phenanthrenecarboxylic acid