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  • 1Physique Experimentale, Universite de Liege, Sart Tilman B5, B-4000 Liege, Belgium. mrspirlet@ulg.ac.be.

Acta Crystallographica. Section C, Crystal Structure Communications
|October 12, 2000
PubMed
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The crystal structure of C(9)H(14)N(2)O(3) reveals molecules forming chains via N-H.O=C bonds. This hydrogen bonding and stable molecular conformation facilitate the formation of large crystals.

Area of Science:

  • Crystallography
  • Molecular Chemistry

Background:

  • Understanding molecular interactions is key in crystal engineering.
  • The title compound, C(9)H(14)N(2)O(3), was synthesized for structural analysis.

Purpose of the Study:

  • To determine the crystal structure of C(9)H(14)N(2)O(3).
  • To investigate the intermolecular interactions governing crystal formation.

Main Methods:

  • Single-crystal X-ray diffraction was employed to elucidate the crystal structure.
  • Analysis of hydrogen bonding patterns and molecular conformation.

Main Results:

  • The crystal structure of C(9)H(14)N(2)O(3) was determined.
  • Molecules are arranged in chains parallel to [001] via N-H.O=C hydrogen bonds.

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  • An energetically stable molecular conformation was observed.

    • Conclusions:

    • Hydrogen bonding and molecular conformation are crucial for crystal packing.
    • The observed interactions readily facilitate the growth of large C(9)H(14)N(2)O(3) crystals.