4-(2-Hydroxy-benzyl-idene-amino)-benzonitrile
1Ordered Matter Science Research Center, College of Chemistry and Chemical Engineering, Southeast University, Nanjing 210096, People's Republic of China.
This study details the molecular structure of a C(14)H(10)N(2)O compound, revealing a nearly planar configuration. Key findings include a strong intramolecular hydrogen bond and an anti configuration around the C=N double bond.
Area of Science:
- Crystallography
- Molecular Chemistry
Background:
- Understanding molecular geometry and bonding is crucial in chemistry.
- Intramolecular hydrogen bonding significantly influences molecular conformation and properties.
Purpose of the Study:
- To elucidate the crystal structure and molecular geometry of the title compound, C(14)H(10)N(2)O.
- To investigate the presence and role of intramolecular hydrogen bonding.
Main Methods:
- Single-crystal X-ray diffraction was employed to determine the molecular structure.
- Analysis of bond lengths, bond angles, and intermolecular interactions was performed.
Main Results:
- The molecule C(14)H(10)N(2)O adopts a nearly planar conformation.
- A strong intramolecular O-H⋯N hydrogen bond was identified between the imine and hydroxyl groups.
- The configuration across the C=N double bond was confirmed as anti (1E).
Conclusions:
- The observed planarity and intramolecular hydrogen bond dictate the molecule's stable conformation.
- The anti (1E) configuration is a significant feature of this compound's structure.
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