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Published on: August 16, 2018
1,5-Bis(2-formyl-phen-oxy)-3-oxapenta-ne
Nívea C F Dionysio1, Jairo Bordinhão, Lorenzo do Canto Visentin
1Instituto de Química, Universidade Federal do Rio de Janeiro, Caixa Postal 68563, 21949-900 Rio de Janeiro, RJ, Brazil.
This study details the molecular structure of C(18)H(18)O(5), revealing two aromatic rings linked by a flexible chain. It highlights a twofold rotation axis and an intramolecular hydrogen bond in the solid state.
Area of Science:
- Organic Chemistry
- Crystallography
Background:
- Understanding molecular structure is crucial for predicting chemical properties.
- Flexible chains and hydrogen bonds significantly influence molecular conformation and interactions.
Purpose of the Study:
- To elucidate the crystal structure and key structural features of the molecule C(18)H(18)O(5).
- To identify symmetry elements and intramolecular interactions within the molecule.
Main Methods:
- Single-crystal X-ray diffraction was employed to determine the molecular and crystal structure.
- Analysis of crystallographic data to identify symmetry operations and hydrogen bonding.
Main Results:
- The molecule C(18)H(18)O(5) possesses two aromatic rings connected by a 3-oxapentane chain.
- A crystallographic twofold rotation axis (C(2)) bisects the central oxygen atom.
- An intramolecular C-H⋯O hydrogen bond was identified in the solid-state structure.
Conclusions:
- The structure of C(18)H(18)O(5) is characterized by its flexible linker and specific symmetry.
- The observed intramolecular hydrogen bond plays a role in stabilizing the observed solid-state conformation.
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