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Dissociative electron attachment to the gas-phase nucleobase hypoxanthine
M Michele Dawley1, Katrin Tanzer2, Ian Carmichael1
1Radiation Laboratory, University of Notre Dame, Notre Dame, Indiana 46556, USA.
The Journal of Chemical Physics
|June 8, 2015
Summary
We studied electron attachment to hypoxanthine, a DNA/RNA base. The primary anion formed is (hypoxanthine - H), crucial for understanding biomolecular radiation damage.
Area of Science:
- Physical Chemistry
- Chemical Physics
- Biophysics
Background:
- Hypoxanthine is a purine base found in tRNA.
- Understanding its interaction with electrons is vital for biomolecular radiation damage studies.
Purpose of the Study:
- To investigate the dissociative electron attachment (DEA) process for gas-phase hypoxanthine.
- To identify anionic fragments and their formation mechanisms.
Main Methods:
- High-resolution measurements of DEA to hypoxanthine.
- Analysis of anion mass spectra and ion efficiency curves.
- Quantum chemical computations (B3LYP, U(MP2-aug-cc-pVDZ+)) for theoretical support.
Main Results:
- Dominant anion formation pathway observed at 1 eV: (hypoxanthine - H) anion (C5H3N4O(-)).
- Tentative assignment of the 1 eV resonance to a dipole-bound state of a specific hypoxanthine tautomer.
- Observation of seven other anions with broad resonances between 4-8 eV.
- Significant fragmentation observed during DEA to hypoxanthine.
Conclusions:
- The (hypoxanthine - H) anion is the primary product of electron attachment to hypoxanthine.
- DEA to hypoxanthine results in extensive fragmentation, relevant to radiation damage mechanisms in biological molecules.
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