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(E)-Benz-yl(1-phenyl-ethyl-idene)amine.

Sean H Majer1, Joseph M Tanski

  • 1Department of Chemistry, Vassar College, Poughkeepsie, NY 12604, USA.

Acta Crystallographica. Section E, Structure Reports Online
|October 11, 2013
PubMed
Summary
This summary is machine-generated.

This study details the molecular structure of a specific E isomer compound (C15H15N). Researchers found a minor positional disorder and a planar molecular geometry, with no observed pi-stacking interactions.

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Area of Science:

  • Organic Chemistry
  • Crystallography

Background:

  • Understanding molecular structure is crucial for predicting chemical properties.
  • Isomeric compounds can exhibit distinct physical and chemical behaviors.

Purpose of the Study:

  • To elucidate the precise three-dimensional structure of the title compound, C15H15N.
  • To investigate molecular geometry, bond characteristics, and crystal packing.

Main Methods:

  • Single-crystal X-ray diffraction was employed to analyze the compound.
  • Structural parameters including bond lengths, angles, and torsion angles were determined.

Main Results:

  • The compound was identified as an E isomer.
  • A minor disorder was observed, with methyl-benzylidene and benzyl groups interchanging positions (9.1%).
  • The molecule exhibits a nearly planar geometry (maximal twist of 8.5°), with a C=N bond length of 1.292 Å.
  • Herringbone packing was noted, but without significant π-stacking interactions.

Conclusions:

  • The study provides a detailed structural characterization of the E isomer of C15H15N.
  • The observed molecular planarity and packing arrangement offer insights into intermolecular forces and solid-state behavior.